![R8Y R8Y](https://data.pdbj.org/pdbjplus/data/cc/svg/R8Y.svg) | R8Y | Name: | N-ethyl-N-(thiophene-2-carbonyl)-beta-alanine | Formula: | C10 H13 N O3 S | SMILES: | C(CCN(C(c1sccc1)=O)CC)(O)=O | InChi: | InChI=1S/C10H13NO3S/c1-2-11(6-5-9(12)13)10(14)8-4-3-7-15-8/h3-4,7H,2,5-6H2,1H3,(H,12,13) | Definition date: | 2020-02-10 | Last modified: | 2020-05-29 | Release date: | 2020-06-03 | Identifier: | N-ethyl-N-(thiophene-2-carbonyl)-beta-alanine |
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![R9J R9J](https://data.pdbj.org/pdbjplus/data/cc/svg/R9J.svg) | R9J | Name: | 2-methyl-N-(4-methylphenyl)-L-alanine | Formula: | C11 H15 N O2 | SMILES: | c1(ccc(cc1)C)NC(C)(C)C(O)=O | InChi: | InChI=1S/C11H15NO2/c1-8-4-6-9(7-5-8)12-11(2,3)10(13)14/h4-7,12H,1-3H3,(H,13,14) | Definition date: | 2020-02-10 | Last modified: | 2020-05-29 | Release date: | 2020-06-03 | Identifier: | 2-methyl-N-(4-methylphenyl)-L-alanine |
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![R9M R9M](https://data.pdbj.org/pdbjplus/data/cc/svg/R9M.svg) | R9M | Name: | 3-(1,3-thiazol-2-yl)propanoic acid | Formula: | C6 H7 N O2 S | SMILES: | C(C(O)=O)Cc1nccs1 | InChi: | InChI=1S/C6H7NO2S/c8-6(9)2-1-5-7-3-4-10-5/h3-4H,1-2H2,(H,8,9) | Definition date: | 2020-02-10 | Last modified: | 2020-05-29 | Release date: | 2020-06-03 | Identifier: | 3-(1,3-thiazol-2-yl)propanoic acid |
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![RDJ RDJ](https://data.pdbj.org/pdbjplus/data/cc/svg/RDJ.svg) | RDJ | Name: | N-ethyl-2-{[5-(propan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetamide | Formula: | C9 H15 N3 O2 S | SMILES: | c1(SCC(=O)NCC)nnc(o1)C(C)C | InChi: | InChI=1S/C9H15N3O2S/c1-4-10-7(13)5-15-9-12-11-8(14-9)6(2)3/h6H,4-5H2,1-3H3,(H,10,13) | Definition date: | 2020-02-10 | Last modified: | 2020-05-29 | Release date: | 2020-06-03 | Identifier: | N-ethyl-2-{[5-(propan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetamide |
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![RDV RDV](https://data.pdbj.org/pdbjplus/data/cc/svg/RDV.svg) | RDV | Name: | 3-cyclopentyl-1-(piperazin-1-yl)propan-1-one | Formula: | C12 H22 N2 O | SMILES: | C2C(CCC(=O)N1CCNCC1)CCC2 | InChi: | InChI=1S/C12H22N2O/c15-12(14-9-7-13-8-10-14)6-5-11-3-1-2-4-11/h11,13H,1-10H2 | Definition date: | 2020-02-10 | Last modified: | 2020-05-29 | Release date: | 2020-06-03 | Identifier: | 3-cyclopentyl-1-(piperazin-1-yl)propan-1-one |
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![RDY RDY](https://data.pdbj.org/pdbjplus/data/cc/svg/RDY.svg) | RDY | Name: | N-[(benzyloxy)carbonyl]-N-methyl-L-alanine | Formula: | C12 H15 N O4 | SMILES: | O(Cc1ccccc1)C(=O)N(C(C(O)=O)C)C | InChi: | InChI=1S/C12H15NO4/c1-9(11(14)15)13(2)12(16)17-8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,14,15)/t9-/m0/s1 | Definition date: | 2020-02-10 | Last modified: | 2020-05-29 | Release date: | 2020-06-03 | Identifier: | N-[(benzyloxy)carbonyl]-N-methyl-L-alanine |
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![RQD RQD](https://data.pdbj.org/pdbjplus/data/cc/svg/RQD.svg) | RQD | Name: | methyl 4-fluoro-L-phenylalaninate | Formula: | C10 H12 F N O2 | SMILES: | c1(ccc(F)cc1)CC(N)C(OC)=O | InChi: | InChI=1S/C10H12FNO2/c1-14-10(13)9(12)6-7-2-4-8(11)5-3-7/h2-5,9H,6,12H2,1H3/t9-/m0/s1 | Definition date: | 2020-02-20 | Last modified: | 2020-05-29 | Release date: | 2020-06-03 | Identifier: | methyl 4-fluoro-L-phenylalaninate |
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![GOL GOL](https://data.pdbj.org/pdbjplus/data/cc/svg/GOL.svg) | GOL | Name: | GLYCEROL | Formula: | C3 H8 O3 | SMILES: | OCC(O)CO | InChi: | InChI=1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2 | Synonyms: | GLYCERIN | Definition date: | 1999-07-08 | Last modified: | 2020-05-28 | Identifier: | propane-1,2,3-triol |
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![HBB HBB](https://data.pdbj.org/pdbjplus/data/cc/svg/HBB.svg) | HBB | Name: | N-{(2R)-2-HYDROXY-2-[(8S,11S)-8-ISOPROPYL-6,9-DIOXO-2-OXA-7,10-DIAZABICYCLO[11.2.2]HEPTADECA-1(15),13,16-TRIEN-11-YL]ETHYL}-N-ISOPENTYLBENZENESULFONAMIDE | Formula: | C30 H43 N3 O6 S | SMILES: | O=S(=O)(c1ccccc1)N(CCC(C)C)CC(O)C3NC(=O)C(NC(=O)CCCOc2ccc(cc2)C3)C(C)C | InChi: | InChI=1S/C30H43N3O6S/c1-21(2)16-17-33(40(37,38)25-9-6-5-7-10-25)20-27(34)26-19-23-12-14-24(15-13-23)39-18-8-11-28(35)32-29(22(3)4)30(36)31-26/h5-7,9-10,12-15,21-22,26-27,29,34H,8,11,16-20H2,1-4H3,(H,31,36)(H,32,35)/t26-,27+,29-/m0/s1 | Synonyms: | N-[2-HYDROXY-2-(8-ISOPROPYL-6,9-DIOXO-2-OXA-7,10-DIAZA-BICYCLO[11.2.2]HEPTADECA-1(16),13(17),14-TRIEN-11-YL)-ETHYL]-N-(3-METHYL-BUTYL)-BENZENESULFONAMIDE | Definition date: | 2005-03-07 | Last modified: | 2020-05-27 | Identifier: | N-{(2R)-2-hydroxy-2-[(8S,11S)-8-(1-methylethyl)-6,9-dioxo-2-oxa-7,10-diazabicyclo[11.2.2]heptadeca-1(15),13,16-trien-11-yl]ethyl}-N-(3-methylbutyl)benzenesulfonamide |
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![HKS HKS](https://data.pdbj.org/pdbjplus/data/cc/svg/HKS.svg) | HKS | Name: | 3-{[(2S)-2-amino-2-carboxyethyl]sulfanyl}-5-hydroxy-L-tyrosine | Formula: | C12 H16 N2 O6 S | SMILES: | C(O)(C(N)Cc1cc(SCC(N)C(O)=O)c(c(c1)O)O)=O | InChi: | InChI=1S/C12H16N2O6S/c13-6(11(17)18)1-5-2-8(15)10(16)9(3-5)21-4-7(14)12(19)20/h2-3,6-7,15-16H,1,4,13-14H2,(H,17,18)(H,19,20)/t6-,7+/m0/s1 | Synonyms: | 5-cysteinyl-3,4-dihydroxyphenylalanine | Definition date: | 2018-07-10 | Last modified: | 2020-05-27 | Release date: | 2019-05-22 | Identifier: | 3-{[(2S)-2-amino-2-carboxyethyl]sulfanyl}-5-hydroxy-L-tyrosine |
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![CE2 CE2](https://data.pdbj.org/pdbjplus/data/cc/svg/CE2.svg) | CE2 | Name: | 3-(5-TERT-BUTYL-3-OXIDOISOXAZOL-4-YL)-L-ALANINATE | Formula: | C10 H15 N2 O4 | SMILES: | [O-]c1noc(c1CC(C([O-])=O)[NH3+])C(C)(C)C | InChi: | InChI=1S/C10H16N2O4/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H,12,13)(H,14,15)/p-1/t6-/m0/s1 | Synonyms: | (S)-ATPA | Definition date: | 2003-01-24 | Last modified: | 2020-05-27 | Identifier: | (2S)-2-ammonio-3-(5-tert-butyl-3-oxidoisoxazol-4-yl)propanoate |
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![GSN GSN](https://data.pdbj.org/pdbjplus/data/cc/svg/GSN.svg) | GSN | Name: | 2-AMINO-5-[1-(CARBOXYLATOMETHYLCARBAMOYL)-2-NITROSOSULFANYL-ETHYL]AMINO-5-OXO-PENTANOATE | Formula: | C10 H14 N4 O7 S | SMILES: | O=C(NC(C(=O)NCC([O-])=O)CSN=O)CCC(C([O-])=O)N | InChi: | InChI=1S/C10H16N4O7S/c11-5(10(19)20)1-2-7(15)13-6(4-22-14-21)9(18)12-3-8(16)17/h5-6H,1-4,11H2,(H,12,18)(H,13,15)(H,16,17)(H,19,20)/p-2/t5-,6-/m0/s1 | Synonyms: | S-NITROSOGLUTATHIONE | Definition date: | 2005-06-28 | Last modified: | 2020-05-27 | Identifier: | (2S)-2-amino-5-({(1R)-2-[(carboxylatomethyl)amino]-1-[(nitrososulfanyl)methyl]-2-oxoethyl}amino)-5-oxopentanoate |
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![FR4 FR4](https://data.pdbj.org/pdbjplus/data/cc/svg/FR4.svg) | FR4 | Name: | 1-((1R)-1-(HYDROXYMETHYL)-3-{6-[(3-PHENYLPROPANOYL)AMINO]-1H-INDOL-1-YL}PROPYL)-1H-IMIDAZOLE-4-CARBOXAMIDE | Formula: | C25 H27 N5 O3 | SMILES: | O=C(N)c1ncn(c1)C(CO)CCn3c2cc(ccc2cc3)NC(=O)CCc4ccccc4 | InChi: | InChI=1S/C25H27N5O3/c26-25(33)22-15-30(17-27-22)21(16-31)11-13-29-12-10-19-7-8-20(14-23(19)29)28-24(32)9-6-18-4-2-1-3-5-18/h1-5,7-8,10,12,14-15,17,21,31H,6,9,11,13,16H2,(H2,26,33)(H,28,32)/t21-/m1/s1 | Synonyms: | 1-((1R)-1-(HYDROXYMETHYL)-3-{6-[(3-PHENYLPROPYL)AMINO]-1H-INDOL-1-YL}-1H-IMIDAZOLE-4-CARBOXAMIDE | Definition date: | 2003-10-05 | Last modified: | 2020-05-27 | Identifier: | 1-[(1R)-1-(hydroxymethyl)-3-{6-[(3-phenylpropanoyl)amino]-1H-indol-1-yl}propyl]-1H-imidazole-4-carboxamide |
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![B3J B3J](https://data.pdbj.org/pdbjplus/data/cc/svg/B3J.svg) | B3J | Name: | (1S,2S)-2-{[N-({[4-benzyl-1-(tert-butoxycarbonyl)piperidin-4-yl]oxy}carbonyl)-L-leucyl]amino}-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid | Formula: | C31 H48 N4 O10 S | SMILES: | C(CC1CCNC1=O)(C(O)S(=O)(O)=O)NC(C(CC(C)C)NC(=O)OC3(Cc2ccccc2)CCN(CC3)C(OC(C)(C)C)=O)=O | InChi: | InChI=1S/C31H48N4O10S/c1-20(2)17-23(26(37)33-24(27(38)46(41,42)43)18-22-11-14-32-25(22)36)34-28(39)44-31(19-21-9-7-6-8-10-21)12-15-35(16-13-31)29(40)45-30(3,4)5/h6-10,20,22-24,27,38H,11-19H2,1-5H3,(H,32,36)(H,33,37)(H,34,39)(H,41,42,43)/t22-,23-,24-,27-/m0/s1 | Definition date: | 2017-07-31 | Last modified: | 2020-05-27 | Release date: | 2018-04-04 | Identifier: | (1S,2S)-2-{[N-({[4-benzyl-1-(tert-butoxycarbonyl)piperidin-4-yl]oxy}carbonyl)-L-leucyl]amino}-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid |
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![NCG NCG](https://data.pdbj.org/pdbjplus/data/cc/svg/NCG.svg) | NCG | Name: | [(R)-4-((1,3-DIOXOLANE-2-OXY)-4-(S)-YL)-4-HYDROXY]-(R)-10-(2-METHYLAMINO-5-METHYL-2,6-DIDEOXYGALACTOPYRANOSYL-OXY)-(R)-11-(2-HYDROXY-5-METHYL-7-METHOXY-1-NAPHTHOYL-OXY)-(R)-12-S-GLUTATHIONYL-4,10,11,12-TETRAHYDROINDACENE | Formula: | C45 H52 N4 O18 S | SMILES: | O=C(O)C(N)CCC(=O)NC(C(=O)NCC(=O)O)CSC7c3cc1c(C=CC1(O)C2OC(=O)OC2)cc3C(OC4OC(C(O)C(O)C4NC)C)C7OC(=O)c6c5cc(OC)cc(c5ccc6O)C | InChi: | InChI=1S/C45H52N4O18S/c1-18-11-21(62-4)13-23-22(18)5-7-29(50)33(23)42(59)66-38-37(67-43-34(47-3)36(55)35(54)19(2)64-43)24-12-20-9-10-45(61,30-16-63-44(60)65-30)26(20)14-25(24)39(38)68-17-28(40(56)48-15-32(52)53)49-31(51)8-6-27(46)41(57)58/h5,7,9-14,19,27-28,30,34-39,43,47,50,54-55,61H,6,8,15-17,46H2,1-4H3,(H,48,56)(H,49,51)(H,52,53)(H,57,58)/t19-,27-,28+,30-,34-,35+,36-,37-,38+,39+,43-,45-/m1/s1 | Synonyms: | NCSI-GLU | Definition date: | 2002-09-26 | Last modified: | 2020-05-27 | Identifier: | D-gamma-glutamyl-S-{(1S,2S,3R,7R)-3-{[2,6-dideoxy-2-(methylamino)-alpha-D-galactopyranosyl]oxy}-7-hydroxy-2-{[(2-hydroxy-7-methoxy-5-methylnaphthalen-1-yl)carbonyl]oxy}-7-[(4R)-2-oxo-1,3-dioxolan-4-yl]-1,2,3,7-tetrahydro-s-indacen-1-yl}-L-cysteinylglycine |
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![M77 M77](https://data.pdbj.org/pdbjplus/data/cc/svg/M77.svg) | M77 | Name: | 5-(1,4-DIAZEPAN-1-SULFONYL)ISOQUINOLINE | Formula: | C14 H17 N3 O2 S | SMILES: | O=S(=O)(c2c1ccncc1ccc2)N3CCCNCC3 | InChi: | InChI=1S/C14H17N3O2S/c18-20(19,17-9-2-6-15-8-10-17)14-4-1-3-12-11-16-7-5-13(12)14/h1,3-5,7,11,15H,2,6,8-10H2 | Synonyms: | Fasudil | Definition date: | 2003-08-26 | Last modified: | 2020-05-27 | Identifier: | 5-(1,4-diazepan-1-ylsulfonyl)isoquinoline |
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![NJV NJV](https://data.pdbj.org/pdbjplus/data/cc/svg/NJV.svg) | NJV | Name: | 5-(4-cyclopropyl-1H-imidazol-1-yl)-2-fluoro-4-methyl-N-{6-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]pyridin-2-yl}benzamide | Formula: | C24 H24 F N7 O | SMILES: | c3(cc(c(n2cc(C1CC1)nc2)cc3C(Nc4nc(ccc4)c5n(cnn5)C(C)C)=O)C)F | InChi: | InChI=1S/C24H24FN7O/c1-14(2)32-13-27-30-23(32)19-5-4-6-22(28-19)29-24(33)17-10-21(15(3)9-18(17)25)31-11-20(26-12-31)16-7-8-16/h4-6,9-14,16H,7-8H2,1-3H3,(H,28,29,33) | Synonyms: | Selonsertib | Definition date: | 2019-05-15 | Last modified: | 2020-05-27 | Release date: | 2019-11-27 | Identifier: | 5-(4-cyclopropyl-1H-imidazol-1-yl)-2-fluoro-4-methyl-N-{6-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]pyridin-2-yl}benzamide |
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![NLT NLT](https://data.pdbj.org/pdbjplus/data/cc/svg/NLT.svg) | NLT | Name: | N-DODECANOYL-L-TYROSINE | Formula: | C21 H33 N O4 | SMILES: | O=C(O)C(NC(=O)CCCCCCCCCCC)Cc1ccc(O)cc1 | InChi: | InChI=1S/C21H33NO4/c1-2-3-4-5-6-7-8-9-10-11-20(24)22-19(21(25)26)16-17-12-14-18(23)15-13-17/h12-15,19,23H,2-11,16H2,1H3,(H,22,24)(H,25,26)/t19-/m0/s1 | Synonyms: | (S)-N-(DODECANOYL)-2-AMINO-3-(4-HYDROXYPHENYL)-PROPANOIC ACID | Definition date: | 2005-01-12 | Last modified: | 2020-05-27 | Identifier: | N-dodecanoyl-L-tyrosine |
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![OSC OSC](https://data.pdbj.org/pdbjplus/data/cc/svg/OSC.svg) | OSC | Name: | (2R,3AS,6R,7AS)-N-(2-{1-[AMINO(IMINO)METHYL]-2,5-DIHYDRO-1H-PYRROL-3-YL}ETHYL)-6-HYDROXY-1-{N-[(2S)-2-HYDROXY-3-PHENYLPROPANOYL]PHENYLALANYL}OCTAHYDRO-1H-INDOLE-2-CARBOXAMIDE | Formula: | C34 H44 N6 O5 | SMILES: | O=C(NC(C(=O)N1C3CC(O)CCC3CC1C(=O)NCCC2=CCN(C(=[N@H])N)C2)Cc4ccccc4)C(O)Cc5ccccc5 | InChi: | InChI=1S/C34H44N6O5/c35-34(36)39-16-14-24(21-39)13-15-37-31(43)29-19-25-11-12-26(41)20-28(25)40(29)33(45)27(17-22-7-3-1-4-8-22)38-32(44)30(42)18-23-9-5-2-6-10-23/h1-10,14,25-30,41-42H,11-13,15-21H2,(H3,35,36)(H,37,43)(H,38,44)/t25-,26+,27+,28-,29-,30+/m0/s1 | Synonyms: | OSCILLARIN | Definition date: | 2004-01-14 | Last modified: | 2020-05-27 | Identifier: | (2S,3aS,6R,7aS)-N-[2-(1-carbamimidoyl-2,5-dihydro-1H-pyrrol-3-yl)ethyl]-6-hydroxy-1-[(2R)-2-{[(2R)-2-hydroxy-3-phenylpropanoyl]amino}-3-phenylpropanoyl]octahydro-1H-indole-2-carboxamide (non-preferred name) |
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![PEK PEK](https://data.pdbj.org/pdbjplus/data/cc/svg/PEK.svg) | PEK | Name: | (1S)-2-{[(2-AMINOETHOXY)(HYDROXY)PHOSPHORYL]OXY}-1-[(STEAROYLOXY)METHYL]ETHYL (5E,8E,11E,14E)-ICOSA-5,8,11,14-TETRAENOATE | Formula: | C43 H78 N O8 P | SMILES: | O=C(OCC(OC(=O)CCCC=C/CC=C/CC=C/CC=C/CCCCC)COP(=O)(OCCN)O)CCCCCCCCCCCCCCCCC | InChi: | InChI=1S/C43H78NO8P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(46)52-41(40-51-53(47,48)50-38-37-44)39-49-42(45)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h11,13,17,19,22,24,28,30,41H,3-10,12,14-16,18,20-21,23,25-27,29,31-40,44H2,1-2H3,(H,47,48)/b13-11-,19-17-,24-22-,30-28-/t41-/m1/s1 | Synonyms: | PHOSPHATIDYLETHANOLAMINE | Definition date: | 2003-12-02 | Last modified: | 2020-05-27 | Identifier: | (1R)-2-{[(R)-(2-aminoethoxy)(hydroxy)phosphoryl]oxy}-1-[(octadecanoyloxy)methyl]ethyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate |
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![PGV PGV](https://data.pdbj.org/pdbjplus/data/cc/svg/PGV.svg) | PGV | Name: | (1R)-2-{[{[(2S)-2,3-DIHYDROXYPROPYL]OXY}(HYDROXY)PHOSPHORYL]OXY}-1-[(PALMITOYLOXY)METHYL]ETHYL (11E)-OCTADEC-11-ENOATE | Formula: | C40 H77 O10 P | SMILES: | O=C(OC(COP(=O)(OCC(O)CO)O)COC(=O)CCCCCCCCCCCCCCC)CCCCCCCCCC=C/CCCCCC | InChi: | InChI=1S/C40H77O10P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-40(44)50-38(36-49-51(45,46)48-34-37(42)33-41)35-47-39(43)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h13,15,37-38,41-42H,3-12,14,16-36H2,1-2H3,(H,45,46)/b15-13-/t37-,38+/m0/s1 | Synonyms: | PHOSPHATIDYLGLYCEROL | Definition date: | 2003-12-02 | Last modified: | 2020-05-27 | Identifier: | (1R)-2-{[(R)-{[(2S)-2,3-dihydroxypropyl]oxy}(hydroxy)phosphoryl]oxy}-1-[(hexadecanoyloxy)methyl]ethyl (11Z)-octadec-11-enoate |
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![PIF PIF](https://data.pdbj.org/pdbjplus/data/cc/svg/PIF.svg) | PIF | Name: | (2R)-3-{[(S)-hydroxy{[(1R,2R,3R,4R,5S,6R)-2,3,5,6-tetrahydroxy-4-(phosphonooxy)cyclohexyl]oxy}phosphoryl]oxy}propane-1,2-diyl dioctanoate | Formula: | C25 H48 O16 P2 | SMILES: | O=C(OCC(OC(=O)CCCCCCC)COP(=O)(O)OC1C(O)C(O)C(OP(=O)(O)O)C(O)C1O)CCCCCCC | InChi: | InChI=1S/C25H48O16P2/c1-3-5-7-9-11-13-18(26)37-15-17(39-19(27)14-12-10-8-6-4-2)16-38-43(35,36)41-25-22(30)20(28)24(21(29)23(25)31)40-42(32,33)34/h17,20-25,28-31H,3-16H2,1-2H3,(H,35,36)(H2,32,33,34)/t17-,20-,21+,22-,23-,24+,25+/m1/s1 | Synonyms: | L-ALPHA-D-MYOPHOSPHATIDYLINOSITOL 4-PHOSPHATE | Definition date: | 2010-05-11 | Last modified: | 2020-05-27 | Identifier: | (2R)-3-{[(S)-hydroxy{[(1R,2R,3R,4R,5S,6R)-2,3,5,6-tetrahydroxy-4-(phosphonooxy)cyclohexyl]oxy}phosphoryl]oxy}propane-1,2-diyl dioctanoate |
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![Q3G Q3G](https://data.pdbj.org/pdbjplus/data/cc/svg/Q3G.svg) | Q3G | Name: | O-[(R)-[(2S)-2-(hexadecanoyloxy)-3-(octadecanoyloxy)propoxy](hydroxy)phosphoryl]-D-serine | Formula: | C40 H78 N O10 P | SMILES: | C(CCCCCCCCC)CCCCCCCC(=O)OCC(COP(=O)(O)OCC(C(O)=O)N)OC(=O)CCCCCCCCCCCCCCC | InChi: | InChI=1S/C40H78NO10P/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(42)48-33-36(34-49-52(46,47)50-35-37(41)40(44)45)51-39(43)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h36-37H,3-35,41H2,1-2H3,(H,44,45)(H,46,47)/t36-,37+/m0/s1 | Definition date: | 2019-09-12 | Last modified: | 2020-05-27 | Release date: | 2019-10-23 | Identifier: | O-[(R)-[(2S)-2-(hexadecanoyloxy)-3-(octadecanoyloxy)propoxy](hydroxy)phosphoryl]-D-serine |
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![POG POG](https://data.pdbj.org/pdbjplus/data/cc/svg/POG.svg) | POG | Name: | (20S)-2,5,8,11,14,17-HEXAMETHYL-3,6,9,12,15,18-HEXAOXAHENICOSANE-1,20-DIOL | Formula: | C21 H44 O8 | SMILES: | O(CC(O)C)C(COC(C)COC(C)COC(C)COC(C)COC(C)CO)C | InChi: | InChI=1S/C21H44O8/c1-15(23)9-24-17(3)11-26-19(5)13-28-21(7)14-29-20(6)12-27-18(4)10-25-16(2)8-22/h15-23H,8-14H2,1-7H3/t15-,16?,17?,18?,19?,20?,21?/m1/s1 | Synonyms: | POLYPROPYLENE GLYCOL | Definition date: | 2004-09-01 | Last modified: | 2020-05-27 | Identifier: | (20R)-2,5,8,11,14,17-hexamethyl-3,6,9,12,15,18-hexaoxahenicosane-1,20-diol |
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![R6C R6C](https://data.pdbj.org/pdbjplus/data/cc/svg/R6C.svg) | R6C | Name: | (2R)-2-{[6-(BENZYLOXY)-9-ISOPROPYL-9H-PURIN-2-YL]AMINO}BUTAN-1-OL | Formula: | C19 H25 N5 O2 | SMILES: | n2c1c(ncn1C(C)C)c(nc2NC(CC)CO)OCc3ccccc3 | InChi: | InChI=1S/C19H25N5O2/c1-4-15(10-25)21-19-22-17-16(20-12-24(17)13(2)3)18(23-19)26-11-14-8-6-5-7-9-14/h5-9,12-13,15,25H,4,10-11H2,1-3H3,(H,21,22,23)/t15-/m1/s1 | Synonyms: | O6-(R)-ROSCOVITINE | Definition date: | 2005-01-07 | Last modified: | 2020-05-27 | Identifier: | (2R)-2-{[6-(benzyloxy)-9-(1-methylethyl)-9H-purin-2-yl]amino}butan-1-ol |
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