| A1LTQ | Name: | ADP-RIBOXANATED ARGININE | Formula: | C21 H32 N8 O15 P2 | SMILES: | N[CH](CCCN1[CH]2O[CH](CO[P](O)(=O)O[P](O)(=O)OC[CH]3O[CH]([CH](O)[CH]3O)n4cnc5c(N)ncnc45)[CH](O)[CH]2OC1=N)C(O)=O | InChi: | InChI=1S/C21H32N8O15P2/c22-8(20(33)34)2-1-3-28-19-15(43-21(28)24)13(31)10(42-19)5-40-46(37,38)44-45(35,36)39-4-9-12(30)14(32)18(41-9)29-7-27-11-16(23)25-6-26-17(11)29/h6-10,12-15,18-19,24,30-32H,1-5,22H2,(H,33,34)(H,35,36)(H,37,38)(H2,23,25,26)/b24-21+/t8-,9+,10+,12+,13+,14+,15+,18+,19-/m0/s1 | Synonyms: | 5-[5-[[[[5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxymethyl]-2-azanylidene-6-oxidanyl-3~{a},5,6,6~{a}-tetrahydrofuro[2,3-d][1,3]oxazol-3-yl]-2-azanyl-pentanoic acid | Definition date: | 2024-01-22 | Last modified: | 2024-09-27 | Release date: | 2024-07-03 | Identifier: | 5-[5-[[[[5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxymethyl]-2-azanylidene-6-oxidanyl-3~{a},5,6,6~{a}-tetrahydrofuro[2,3-d][1,3]oxazol-3-yl]-2-azanyl-pentanoic acid |
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| A1LVQ | Name: | CXF007 | Formula: | C34 H33 N7 O5 | SMILES: | COc1cc(OC)cc(c1)N2Cc3cnc(Nc4ccccc4NC(=O)C=C)nc3N(CCc5ccc(NC(=O)C=C)cc5)C2=O | InChi: | InChI=1S/C34H33N7O5/c1-5-30(42)36-24-13-11-22(12-14-24)15-16-40-32-23(21-41(34(40)44)25-17-26(45-3)19-27(18-25)46-4)20-35-33(39-32)38-29-10-8-7-9-28(29)37-31(43)6-2/h5-14,17-20H,1-2,15-16,21H2,3-4H3,(H,36,42)(H,37,43)(H,35,38,39) | Synonyms: | ~{N}-[4-[2-[3-(3,5-dimethoxyphenyl)-2-oxidanylidene-7-[[2-(prop-2-enoylamino)phenyl]amino]-4~{H}-pyrimido[4,5-d]pyrimidin-1-yl]ethyl]phenyl]propanamide | Definition date: | 2024-01-04 | Last modified: | 2024-09-27 | Release date: | 2024-03-27 | Identifier: | ~{N}-[4-[2-[3-(3,5-dimethoxyphenyl)-2-oxidanylidene-7-[[2-(prop-2-enoylamino)phenyl]amino]-4~{H}-pyrimido[4,5-d]pyrimidin-1-yl]ethyl]phenyl]prop-2-enamide |
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| FOS | Name: | [[N-(BENZYLOXYCARBONYL)AMINO]METHYL]PHOSPHATE | Formula: | C9 H12 N O5 P | SMILES: | O=P(O)(O)CNC(=O)OCc1ccccc1 | InChi: | InChI=1S/C9H12NO5P/c11-9(10-7-16(12,13)14)15-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11)(H2,12,13,14) | Definition date: | 1999-07-08 | Last modified: | 2024-09-27 | Identifier: | ({[(benzyloxy)carbonyl]amino}methyl)phosphonic acid |
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| FP5 | Name: | PHENYLACETAMIDOMETHYL BORONIC ACID | Formula: | C9 H12 B N O3 | SMILES: | OB(O)CNC(=O)Cc1ccccc1 | InChi: | InChI=1S/C9H12BNO3/c12-9(11-7-10(13)14)6-8-4-2-1-3-5-8/h1-5,13-14H,6-7H2,(H,11,12) | Definition date: | 2011-01-12 | Last modified: | 2024-09-27 | Identifier: | (2-phenylethanoylamino)methylboronic acid |
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| FP7 | Name: | 5-(3,5-dimethyl-1,2-oxazol-4-yl)-1-({4-[(1R)-1-hydroxyethyl]phenyl}methyl)pyridin-2(1H)-one | Formula: | C19 H20 N2 O3 | SMILES: | c3cc(CN2C=C(c1c(C)noc1C)C=CC2=O)ccc3C(C)O | InChi: | InChI=1S/C19H20N2O3/c1-12-19(14(3)24-20-12)17-8-9-18(23)21(11-17)10-15-4-6-16(7-5-15)13(2)22/h4-9,11,13,22H,10H2,1-3H3/t13-/m1/s1 | Definition date: | 2018-04-11 | Last modified: | 2024-09-27 | Release date: | 2018-09-26 | Identifier: | 5-(3,5-dimethyl-1,2-oxazol-4-yl)-1-({4-[(1R)-1-hydroxyethyl]phenyl}methyl)pyridin-2(1H)-one |
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| FP8 | Name: | (1R,2S)-1-hydroxy-2-[(N-{[(2-methyl-2-azaspiro[3.3]heptan-6-yl)oxy]carbonyl}-L-leucyl)amino]-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid | Formula: | C28 H40 N4 O9 S | SMILES: | O=C(Cc1ccccc1)N1CC2(CC(C2)OC(=O)NC(CC(C)C)C(=O)NC(CC2CCNC2=O)C(O)S(=O)(=O)O)C1 | InChi: | InChI=1S/C28H40N4O9S/c1-17(2)10-21(25(35)30-22(26(36)42(38,39)40)12-19-8-9-29-24(19)34)31-27(37)41-20-13-28(14-20)15-32(16-28)23(33)11-18-6-4-3-5-7-18/h3-7,17,19-22,26,36H,8-16H2,1-2H3,(H,29,34)(H,30,35)(H,31,37)(H,38,39,40)/t19-,21-,22-,26+/m0/s1 | Definition date: | 2021-12-15 | Last modified: | 2024-09-27 | Release date: | 2021-12-22 | Identifier: | (1R,2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]-2-{[N-({[2-(phenylacetyl)-2-azaspiro[3.3]heptan-6-yl]oxy}carbonyl)-L-leucyl]amino}propane-1-sulfonic acid |
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| FPA | Name: | bromo(difluoro)acetic acid | Formula: | C2 H Br F2 O2 | SMILES: | C(F)(F)(C(=O)O)Br | InChi: | InChI=1S/C2HBrF2O2/c3-2(4,5)1(6)7/h(H,6,7) | Definition date: | 1999-07-08 | Last modified: | 2024-09-27 | Identifier: | bromo(difluoro)acetic acid |
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| FPJ | Name: | 5'-O-[(R)-hydroxy(propanoylamino)phosphoryl]adenosine | Formula: | C13 H19 N6 O7 P | SMILES: | c2n(c1c(c(ncn1)N)n2)C3C(C(O)C(COP(NC(=O)CC)(O)=O)O3)O | InChi: | InChI=1S/C13H19N6O7P/c1-2-7(20)18-27(23,24)25-3-6-9(21)10(22)13(26-6)19-5-17-8-11(14)15-4-16-12(8)19/h4-6,9-10,13,21-22H,2-3H2,1H3,(H2,14,15,16)(H2,18,20,23,24)/t6-,9-,10-,13-/m1/s1 | Definition date: | 2018-04-11 | Last modified: | 2024-09-27 | Release date: | 2018-08-08 | Identifier: | 5'-O-[(R)-hydroxy(propanoylamino)phosphoryl]adenosine |
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| FPR | Name: | (3S)-3-amino-4-oxo-7-phenylheptanoic acid | Formula: | C13 H17 N O3 | SMILES: | O=C(O)CC(N)C(=O)CCCc1ccccc1 | InChi: | InChI=1S/C13H17NO3/c14-11(9-13(16)17)12(15)8-4-7-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9,14H2,(H,16,17)/t11-/m0/s1 | Definition date: | 2003-11-19 | Last modified: | 2024-09-27 | Identifier: | (3S)-3-amino-4-oxo-7-phenylheptanoic acid |
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| FQA | Name: | N~6~-benzyl-L-lysine | Formula: | C13 H20 N2 O2 | SMILES: | NC(C(O)=O)CCCCNCc1ccccc1 | InChi: | InChI=1S/C13H20N2O2/c14-12(13(16)17)8-4-5-9-15-10-11-6-2-1-3-7-11/h1-3,6-7,12,15H,4-5,8-10,14H2,(H,16,17)/t12-/m0/s1 | Definition date: | 2018-04-12 | Last modified: | 2024-09-27 | Release date: | 2019-04-10 | Identifier: | N~6~-benzyl-L-lysine |
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| FQZ | Name: | (1~{R},3~{S},4~{R},5~{R})-3-methyl-4,5-bis(hydroxyl)cyclohexane-1-carboxylic acid | Formula: | C8 H14 O4 | SMILES: | C[CH]1C[CH](C[CH](O)[CH]1O)C(O)=O | InChi: | InChI=1S/C8H14O4/c1-4-2-5(8(11)12)3-6(9)7(4)10/h4-7,9-10H,2-3H2,1H3,(H,11,12)/t4-,5+,6+,7+/m0/s1 | Definition date: | 2018-07-25 | Last modified: | 2024-09-27 | Release date: | 2019-07-24 | Identifier: | (1~{R},3~{S},4~{R},5~{R})-3-methyl-4,5-bis(oxidanyl)cyclohexane-1-carboxylic acid |
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| FRW | Name: | 4-[[(2S)-3-methyl-1-oxo-1-[(2S)-2-[[(3S)-1,1,1-trifluoro-4-methyl-2-oxo-pentan-3-yl]carbamoyl]pyrrolidin-1-yl]butan-2-yl]carbamoyl]benzoic acid | Formula: | C24 H30 F3 N3 O6 | SMILES: | O=C(NC(C(=O)C(F)(F)F)C(C)C)C2N(C(=O)C(NC(=O)c1ccc(C(=O)O)cc1)C(C)C)CCC2 | InChi: | InChI=1S/C24H30F3N3O6/c1-12(2)17(19(31)24(25,26)27)28-21(33)16-6-5-11-30(16)22(34)18(13(3)4)29-20(32)14-7-9-15(10-8-14)23(35)36/h7-10,12-13,16-18H,5-6,11H2,1-4H3,(H,28,33)(H,29,32)(H,35,36)/t16-,17-,18-/m0/s1 | Definition date: | 2009-05-26 | Last modified: | 2024-09-27 | Identifier: | N-[(4-carboxyphenyl)carbonyl]-L-valyl-N-[(1S)-3,3,3-trifluoro-1-(1-methylethyl)-2-oxopropyl]-L-prolinamide |
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| FSH | Name: |
(2R,3S,4S)-5-[(4R)-6',7'-dimethyl-2,3',5-trioxo-1'H-spiro[imidazolidine-4,2'-quinoxalin]-4'(3'H)-yl]-2,3,4-trihydroxypentyl-adenosine diphosphate | Formula: | C27 H35 N9 O16 P2 | SMILES: | O=C1NC(=O)NC13Nc2cc(c(cc2N(C3=O)CC(O)C(O)C(O)COP(=O)(O)OP(=O)(O)OCC6OC(n5cnc4c(ncnc45)N)C(O)C6O)C)C | InChi: | InChI=1S/C27H35N9O16P2/c1-10-3-12-13(4-11(10)2)35(25(43)27(33-12)24(42)32-26(44)34-27)5-14(37)18(39)15(38)6-49-53(45,46)52-54(47,48)50-7-16-19(40)20(41)23(51-16)36-9-31-17-21(28)29-8-30-22(17)36/h3-4,8-9,14-16,18-20,23,33,37-41H,5-7H2,1-2H3,(H,45,46)(H,47,48)(H2,28,29,30)(H2,32,34,42,44)/t14-,15+,16+,18-,19+,20+,23+,27+/m0/s1 | Definition date: | 2008-06-04 | Last modified: | 2024-09-27 | Identifier: | [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2R,3S,4S)-5-[(4R)-6',7'-dimethyl-2,3',5-trioxo-1'H-spiro[imidazolidine-4,2'-quinoxalin]-4'(3'H)-yl]-2,3,4-trihydroxypentyl dihydrogen diphosphate (non-preferred name) |
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| FSL | Name: | (2R)-2-phenylbutanedioic acid | Formula: | C10 H10 O4 | SMILES: | O=C(O)C(c1ccccc1)CC(=O)O | InChi: | InChI=1S/C10H10O4/c11-9(12)6-8(10(13)14)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,11,12)(H,13,14)/t8-/m1/s1 | Definition date: | 2014-07-23 | Last modified: | 2024-09-27 | Release date: | 2014-08-20 | Identifier: | (2R)-2-phenylbutanedioic acid |
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| FSQ | Name: | (1~{S},3~{R},4~{S},5~{R})-3-methyl-3,4,5-tris(hydroxyl)cyclohexane-1-carboxylic Acid | Formula: | C8 H14 O5 | SMILES: | C[C]1(O)C[CH](C[CH](O)[CH]1O)C(O)=O | InChi: | InChI=1S/C8H14O5/c1-8(13)3-4(7(11)12)2-5(9)6(8)10/h4-6,9-10,13H,2-3H2,1H3,(H,11,12)/t4-,5+,6-,8+/m0/s1 | Definition date: | 2018-07-25 | Last modified: | 2024-09-27 | Release date: | 2019-07-24 | Identifier: | (1~{S},3~{R},4~{S},5~{R})-3-methyl-3,4,5-tris(oxidanyl)cyclohexane-1-carboxylic acid |
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| FSR | Name: | (2S,3S,4R,5R,6R)-5-acetamido-2,3-bis(fluoranyl)-4-oxidanyl-6-[(1S,2S)-1,2,3-tris(oxidanyl)propyl]oxane-2-carboxylic
acid | Formula: | C11 H17 F2 N O8 | SMILES: | FC1(OC(C(NC(=O)C)C(O)C1F)C(O)C(O)CO)C(=O)O | InChi: | InChI=1S/C11H17F2NO8/c1-3(16)14-5-7(19)9(12)11(13,10(20)21)22-8(5)6(18)4(17)2-15/h4-9,15,17-19H,2H2,1H3,(H,14,16)(H,20,21)/t4-,5+,6-,7+,8+,9-,11+/m0/s1 | Synonyms: | 2,3-difluorosialic acid | Definition date: | 2013-10-28 | Last modified: | 2024-09-27 | Release date: | 2013-12-25 | Identifier: | (2R,3S,4R,5R,6R)-5-(acetylamino)-2,3-difluoro-4-hydroxy-6-[(1S,2S)-1,2,3-trihydroxypropyl]tetrahydro-2H-pyran-2-carboxy
lic acid (non-preferred name) |
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| FT5 | Name: | (3~{R})-3,4,5-tris(hydroxyl)cyclohexane-1-carboxylic acid | Formula: | C7 H12 O5 | SMILES: | O[CH]1C[CH](C[CH](O)[CH]1O)C(O)=O | InChi: | InChI=1S/C7H12O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h3-6,8-10H,1-2H2,(H,11,12)/t3-,4+,5-,6- | Definition date: | 2018-07-25 | Last modified: | 2024-09-27 | Release date: | 2019-07-24 | Identifier: | (3~{R})-3,4,5-tris(oxidanyl)cyclohexane-1-carboxylic acid |
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| FT6 | Name: | 6-FLUORO-L-TRYPTOPHAN | Formula: | C11 H11 F N2 O2 | SMILES: | O=C(O)C(N)Cc2c1ccc(F)cc1nc2 | InChi: | InChI=1S/C11H11FN2O2/c12-7-1-2-8-6(3-9(13)11(15)16)5-14-10(8)4-7/h1-2,4-5,9,14H,3,13H2,(H,15,16)/t9-/m0/s1 | Synonyms: | (S)-2-AMINO-3-(6-FLUORO-1H-INDOL-3-YL)PROPANOIC ACID | Definition date: | 2006-11-20 | Last modified: | 2024-09-27 | Identifier: | 6-fluoro-L-tryptophan |
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| FTR | Name: | FLUOROTRYPTOPHANE | Formula: | C11 H11 F N2 O2 | SMILES: | O=C(O)C(N)Cc2c1cc(F)ccc1nc2 | InChi: | InChI=1S/C11H11FN2O2/c12-7-1-2-10-8(4-7)6(5-14-10)3-9(13)11(15)16/h1-2,4-5,9,14H,3,13H2,(H,15,16)/t9-/m0/s1 | Definition date: | 1999-07-08 | Last modified: | 2024-09-27 | Identifier: | 5-fluoro-L-tryptophan |
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| FTY | Name: | DEOXY-DIFLUOROMETHELENE-PHOSPHOTYROSINE | Formula: | C10 H12 F2 N O5 P | SMILES: | FC(F)(c1ccc(cc1)CC(N)C(=O)O)P(=O)(O)O | InChi: | InChI=1S/C10H12F2NO5P/c11-10(12,19(16,17)18)7-3-1-6(2-4-7)5-8(13)9(14)15/h1-4,8H,5,13H2,(H,14,15)(H2,16,17,18)/t8-/m0/s1 | Definition date: | 1999-07-08 | Last modified: | 2024-09-27 | Identifier: | 4-[difluoro(phosphono)methyl]-L-phenylalanine |
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| FU2 | Name: | FURFURAL | Formula: | C5 H4 O2 | SMILES: | O=Cc1occc1 | InChi: | InChI=1S/C5H4O2/c6-4-5-2-1-3-7-5/h1-4H | Definition date: | 2003-09-10 | Last modified: | 2024-09-27 | Identifier: | furan-2-carbaldehyde |
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| FUC | Name: | alpha-L-fucopyranose | Formula: | C6 H12 O5 | SMILES: | OC1C(O)C(OC(O)C1O)C | InChi: | InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3+,4+,5-,6+/m0/s1 | Synonyms: | alpha-L-fucose | Definition date: | 1999-07-08 | Last modified: | 2024-09-27 | Identifier: | 6-deoxy-alpha-L-galactopyranose |
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| FUF | Name: | 2-deoxy-2-fluoro-beta-L-fucopyranose | Formula: | C6 H11 F O4 | SMILES: | FC1C(O)C(O)C(OC1O)C | InChi: | InChI=1S/C6H11FO4/c1-2-4(8)5(9)3(7)6(10)11-2/h2-6,8-10H,1H3/t2-,3-,4+,5-,6-/m0/s1 | Synonyms: | 2,6-DIDEOXY-2-FLUORO-BETA-L-LYXO-HEXOPYRANOSE | Definition date: | 2003-03-14 | Last modified: | 2024-09-27 | Identifier: | 2,6-dideoxy-2-fluoro-beta-L-galactopyranose |
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| FUL | Name: | beta-L-fucopyranose | Formula: | C6 H12 O5 | SMILES: | OC1C(O)C(OC(O)C1O)C | InChi: | InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3+,4+,5-,6-/m0/s1 | Synonyms: | beta-L-fucose | Definition date: | 2002-01-15 | Last modified: | 2024-09-27 | Identifier: | 6-deoxy-beta-L-galactopyranose |
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| FUM | Name: | FUMARIC ACID | Formula: | C4 H4 O4 | SMILES: | O=C(O)C=CC(=O)O | InChi: | InChI=1S/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/b2-1+ | Definition date: | 1999-07-08 | Last modified: | 2024-09-27 | Identifier: | (2E)-but-2-enedioic acid |
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