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CXM
CXM
Name:N-CARBOXYMETHIONINE
Formula:C6 H11 N O4 S
SMILES:O=C(O)NC(C(=O)O)CCSC
InChi:InChI=1S/C6H11NO4S/c1-12-3-2-4(5(8)9)7-6(10)11/h4,7H,2-3H2,1H3,(H,8,9)(H,10,11)/t4-/m0/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:N-carboxy-L-methionine
CXP
CXP
Name:CYCLOHEXANE PROPIONIC ACID
Formula:C9 H16 O2
SMILES:O=C(O)CCC1CCCCC1
InChi:InChI=1S/C9H16O2/c10-9(11)7-6-8-4-2-1-3-5-8/h8H,1-7H2,(H,10,11)
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:3-cyclohexylpropanoic acid
CXU
CXU
Name:CLOXACILLIN (OPEN FORM)
Formula:C19 H20 Cl N3 O5 S
SMILES:O=C(NC(C=O)C1SC(C(N1)C(=O)O)(C)C)c3c(onc3c2ccccc2Cl)C
InChi:InChI=1S/C19H20ClN3O5S/c1-9-13(14(23-28-9)10-6-4-5-7-11(10)20)16(25)21-12(8-24)17-22-15(18(26)27)19(2,3)29-17/h4-8,12,15,17,22H,1-3H3,(H,21,25)(H,26,27)/t12-,15+,17-/m1/s1
Synonyms:(2R,4S)-2-[(1R)-1-({[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}amino)-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid
Definition date:2011-08-16
Last modified:2024-09-27
Identifier:(2R,4S)-2-[(1R)-1-({[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}amino)-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid
CXV
CXV
Name:(2R,4S)-2-[(1S)-1-({[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}amino)-2-oxoethyl]-5,5-dimethyl-1,3-thiazolid ine-4-carboxylic acid
Formula:C19 H20 Cl N3 O5 S
SMILES:O=C(NC(C=O)C1SC(C(N1)C(=O)O)(C)C)c3c(onc3c2ccccc2Cl)C
InChi:InChI=1S/C19H20ClN3O5S/c1-9-13(14(23-28-9)10-6-4-5-7-11(10)20)16(25)21-12(8-24)17-22-15(18(26)27)19(2,3)29-17/h4-8,12,15,17,22H,1-3H3,(H,21,25)(H,26,27)/t12-,15-,17+/m0/s1
Synonyms:CLOXACILLIN open form (1R form)
Definition date:2011-08-17
Last modified:2024-09-27
Identifier:(2R,4S)-2-[(1S)-1-({[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}amino)-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid
CY0
CY0
Name:S-{3-[(4-ANILINOQUINAZOLIN-6-YL)AMINO]-3-OXOPROPYL}-L-CYSTEINE
Formula:C20 H21 N5 O3 S
SMILES:O=C(O)C(N)CSCCC(=O)Nc3cc1c(ncnc1Nc2ccccc2)cc3
InChi:InChI=1S/C20H21N5O3S/c21-16(20(27)28)11-29-9-8-18(26)24-14-6-7-17-15(10-14)19(23-12-22-17)25-13-4-2-1-3-5-13/h1-7,10,12,16H,8-9,11,21H2,(H,24,26)(H,27,28)(H,22,23,25)/t16-/m0/s1
Definition date:2006-09-14
Last modified:2024-09-27
Identifier:S-(3-oxo-3-{[4-(phenylamino)quinazolin-6-yl]amino}propyl)-L-cysteine
CY1
CY1
Name:ACETAMIDOMETHYLCYSTEINE
Formula:C6 H12 N2 O3 S
SMILES:O=C(NCSCC(C(=O)O)N)C
InChi:InChI=1S/C6H12N2O3S/c1-4(9)8-3-12-2-5(7)6(10)11/h5H,2-3,7H2,1H3,(H,8,9)(H,10,11)/t5-/m0/s1
Definition date:1999-10-12
Last modified:2024-09-27
Identifier:S-[(acetylamino)methyl]-L-cysteine
CY3
CY3
Name:2-AMINO-3-MERCAPTO-PROPIONAMIDE
Formula:C3 H8 N2 O S
SMILES:O=C(N)C(N)CS
InChi:InChI=1S/C3H8N2OS/c4-2(1-7)3(5)6/h2,7H,1,4H2,(H2,5,6)/t2-/m0/s1
Definition date:1999-10-22
Last modified:2024-09-27
Identifier:L-cysteinamide
CY4
CY4
Name:S-BUTYRYL-CYSTEIN
Formula:C7 H13 N O3 S
SMILES:O=C(O)C(N)CSC(=O)CCC
InChi:InChI=1S/C7H13NO3S/c1-2-3-6(9)12-4-5(8)7(10)11/h5H,2-4,8H2,1H3,(H,10,11)/t5-/m0/s1
Definition date:2002-07-10
Last modified:2024-09-27
Identifier:S-butanoyl-L-cysteine
CY6
CY6
Name:N-((3S,6R)-6-((S,E)-4-ETHOXYCARBONYL-1-((S)-2-OXOPYRROLIDIN-3-YL)BUT-3-EN-2-YLCARBAMOYL)-2,9-DIMETHYL-4-OXODEC-8-EN-3-YL)-5-METHYLISOXAZOLE-3-CARBOXAMIDE
Formula:C29 H42 N4 O7
SMILES:O=C(NC(C(=O)CC(C(=O)NC(C=CC(=O)OCC)CC1C(=O)NCC1)CC=C(/C)C)C(C)C)c2noc(c2)C
InChi:InChI=1S/C29H42N4O7/c1-7-39-25(35)11-10-22(15-21-12-13-30-27(21)36)31-28(37)20(9-8-17(2)3)16-24(34)26(18(4)5)32-29(38)23-14-19(6)40-33-23/h8,10-11,14,18,20-22,26H,7,9,12-13,15-16H2,1-6H3,(H,30,36)(H,31,37)(H,32,38)/b11-10+/t20-,21+,22-,26+/m1/s1
Definition date:2005-09-14
Last modified:2024-09-27
Identifier:ethyl (2E,4S)-4-{[(2R,5S)-6-methyl-2-(3-methylbut-2-en-1-yl)-5-{[(5-methylisoxazol-3-yl)carbonyl]amino}-4-oxoheptanoyl]amino}-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoate
CYC
CYC
Name:PHYCOCYANOBILIN
Formula:C33 H40 N4 O6
SMILES:CC[CH]1[CH](C)C(=O)NC1=Cc2[nH]c(C=C3N=C(C=C4NC(=O)C(=C4C)CC)C(=C3CCC(O)=O)C)c(CCC(O)=O)c2C
InChi:InChI=1S/C33H40N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h13-15,19-20,35H,7-12H2,1-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/b26-13-,27-14-,28-15-/t19-,20-/m1/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:(3R,4R)-4-ethyl-3-methyl-5-methylenepyrrolidin-2-one
CYD
CYD
Name:2-AMINO-6-(CYSTEIN-S-YL)-5-OXO-HEXANOIC ACID
Formula:C9 H16 N2 O5 S
SMILES:O=C(O)C(N)CSCC(=O)CCC(C(=O)O)N
InChi:InChI=1S/C9H16N2O5S/c10-6(8(13)14)2-1-5(12)3-17-4-7(11)9(15)16/h6-7H,1-4,10-11H2,(H,13,14)(H,15,16)/t6-,7-/m0/s1
Definition date:2003-04-04
Last modified:2024-09-27
Identifier:6-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-5-oxo-L-norleucine
CYF
CYF
Name:5-[2-(2-AMINO-2-CARBAMOYL-ETHYLSULFANYL)-ACETYLAMINO]-2-(3,6-DIHYDROXY-9,9A-DIHYDRO-3H-XANTHEN-9-YL)-BENZOIC ACID
Formula:C25 H23 N3 O7 S
SMILES:O=C(N)C(N)CSCC(=O)Nc1ccc(c(C(=O)O)c1)C3c4c(Oc2c3ccc(O)c2)cc(O)cc4
InChi:InChI=1S/C25H23N3O7S/c26-19(24(27)32)10-36-11-22(31)28-12-1-4-15(18(7-12)25(33)34)23-16-5-2-13(29)8-20(16)35-21-9-14(30)3-6-17(21)23/h1-9,19,23,29-30H,10-11,26H2,(H2,27,32)(H,28,31)(H,33,34)/t19-/m0/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:5-[({[(2R)-2,3-diamino-3-oxopropyl]sulfanyl}acetyl)amino]-2-(3,6-dihydroxy-9H-xanthen-9-yl)benzoic acid
CYG
CYG
Name:2-AMINO-4-(AMINO-3-OXO-PROPYLSULFANYLCARBONYL)-BUTYRIC ACID
Formula:C8 H14 N2 O5 S
SMILES:O=C(O)C(N)CSC(=O)CCC(C(=O)O)N
InChi:InChI=1S/C8H14N2O5S/c9-4(7(12)13)1-2-6(11)16-3-5(10)8(14)15/h4-5H,1-3,9-10H2,(H,12,13)(H,14,15)/t4-,5-/m0/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:(2S)-2-amino-5-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-5-oxopentanoic acid
CYJ
CYJ
Name:(Z)-N~6~-[(4R,5S)-5-(2-CARBOXYETHYL)-4-(CARBOXYMETHYL)PIPERIDIN-3-YLIDENE]-L-LYSINE
Formula:C16 H27 N3 O6
SMILES:O=C(O)C(N)CCCC/N=C1/CNCC(CCC(=O)O)C1CC(=O)O
InChi:InChI=1S/C16H27N3O6/c17-12(16(24)25)3-1-2-6-19-13-9-18-8-10(4-5-14(20)21)11(13)7-15(22)23/h10-12,18H,1-9,17H2,(H,20,21)(H,22,23)(H,24,25)/b19-13-/t10-,11-,12+/m1/s1
Synonyms:2-AMINO-6-(3-CARBOXY-1-[(4-CARBOXY-2-OXO-BUTYLAMINO)-METHYL]-PROPYLIDENEAMINO)-HEXANOIC ACID
Definition date:2005-09-11
Last modified:2024-09-27
Identifier:(E)-N~6~-[(4R,5S)-5-(2-carboxyethyl)-4-(carboxymethyl)piperidin-3-ylidene]-L-lysine
CYN
CYN
Name:CYANIDE ION
Formula:C N
SMILES:[C-]#N
InChi:InChI=1S/CN/c1-2/q-1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:cyanide
CYQ
CYQ
Name:2-AMINO-3-PHOSPHONOMETHYLSULFANYL-PROPIONIC ACID
Formula:C4 H10 N O5 P S
SMILES:O=P(O)(O)CSCC(N)C(=O)O
InChi:InChI=1S/C4H10NO5PS/c5-3(4(6)7)1-12-2-11(8,9)10/h3H,1-2,5H2,(H,6,7)(H2,8,9,10)/t3-/m0/s1
Synonyms:S-METHYL PHOSPHOCYSTEINE
Definition date:1999-10-04
Last modified:2024-09-27
Identifier:S-(phosphonomethyl)-L-cysteine
CYR
CYR
Name:N~5~-[{[(2R)-2-AMINO-2-CARBOXYETHYL]SULFANYL}(IMINIO)METHYL]-L-ORNITHINATE
Formula:C9 H19 N4 O4 S
SMILES:O=C(O)C(N)CCCNC(SCC(N)C(=O)O)=[NH2+]
InChi:InChI=1S/C9H18N4O4S/c10-5(7(14)15)2-1-3-13-9(12)18-4-6(11)8(16)17/h5-6H,1-4,10-11H2,(H2,12,13)(H,14,15)(H,16,17)/p+1/t5-,6-/m0/s1
Synonyms:L-CYSTEIN-S-1-(IMINOMETHYL)-L-ORNITHINE
Definition date:2005-08-04
Last modified:2024-09-27
Identifier:{[(4S)-4-amino-4-carboxybutyl]amino}{[(2R)-2-amino-2-carboxyethyl]sulfanyl}methaniminium
CYS
CYS
Name:CYSTEINE
Formula:C3 H7 N O2 S
SMILES:O=C(O)C(N)CS
InChi:InChI=1S/C3H7NO2S/c4-2(1-7)3(5)6/h2,7H,1,4H2,(H,5,6)/t2-/m0/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:L-cysteine
CYW
CYW
Name:S-[(2R)-2-hydroxypropanoyl]-L-cysteine
Formula:C6 H11 N O4 S
SMILES:O=C(SCC(C(=O)O)N)C(O)C
InChi:InChI=1S/C6H11NO4S/c1-3(8)6(11)12-2-4(7)5(9)10/h3-4,8H,2,7H2,1H3,(H,9,10)/t3-,4+/m1/s1
Synonyms:lactoylglutathione
Definition date:2011-02-16
Last modified:2024-09-27
Identifier:S-[(2R)-2-hydroxypropanoyl]-L-cysteine
CYX
CYX
Name:(3-FORMYL-BUT-3-ENYL)-PHOSPHONIC ACID
Formula:C5 H9 O4 P
SMILES:O=CC(=C)CCP(=O)(O)O
InChi:InChI=1S/C5H9O4P/c1-5(4-6)2-3-10(7,8)9/h4H,1-3H2,(H2,7,8,9)
Definition date:2002-09-19
Last modified:2024-09-27
Identifier:(3-formylbut-3-en-1-yl)phosphonic acid
CZ2
CZ2
Name:S-(DIHYDROXYARSINO)CYSTEINE
Formula:C3 H8 As N O4 S
SMILES:O=C(O)C(N)CS[As](O)O
InChi:InChI=1S/C3H8AsNO4S/c5-2(3(6)7)1-10-4(8)9/h2,8-9H,1,5H2,(H,6,7)/t2-/m0/s1
Synonyms:THIARSA DIHYDROXY CYSTEINE
Definition date:2004-03-26
Last modified:2024-09-27
Identifier:S-(dihydroxyarsanyl)-L-cysteine
CZ7
CZ7
Name:({[(2R)-2-{[(4-ethyl-2,3-dioxo-3,4-dihydropyrazin-1(2H)-yl)carbonyl]amino}-2-(4-hydroxyphenyl)acetyl]amino}methyl)boronic acid
Formula:C16 H19 B N4 O7
SMILES:O=C2C(=O)N(C=CN2C(=O)NC(c1ccc(O)cc1)C(=O)NCB(O)O)CC
InChi:InChI=1S/C16H19BN4O7/c1-2-20-7-8-21(15(25)14(20)24)16(26)19-12(13(23)18-9-17(27)28)10-3-5-11(22)6-4-10/h3-8,12,22,27-28H,2,9H2,1H3,(H,18,23)(H,19,26)/t12-/m1/s1
Definition date:2010-04-20
Last modified:2024-09-27
Identifier:({[(2R)-2-{[(4-ethyl-2,3-dioxo-3,4-dihydropyrazin-1(2H)-yl)carbonyl]amino}-2-(4-hydroxyphenyl)acetyl]amino}methyl)boronic acid
CZ8
CZ8
Name:({[(2R)-2-{[(4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl]amino}-4-(4-hydroxyphenyl)butanoyl]amino}methyl)boronic acid
Formula:C18 H25 B N4 O7
SMILES:O=C(NCB(O)O)C(NC(=O)N1C(=O)C(=O)N(CC)CC1)CCc2ccc(O)cc2
InChi:InChI=1S/C18H25BN4O7/c1-2-22-9-10-23(17(27)16(22)26)18(28)21-14(15(25)20-11-19(29)30)8-5-12-3-6-13(24)7-4-12/h3-4,6-7,14,24,29-30H,2,5,8-11H2,1H3,(H,20,25)(H,21,28)/t14-/m1/s1
Definition date:2010-07-30
Last modified:2024-09-27
Identifier:({[(2R)-2-{[(4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl]amino}-4-(4-hydroxyphenyl)butanoyl]amino}methyl)boronic acid
CZ9
CZ9
Name:N-[(dihydroxyboranyl)methyl]-Nalpha-[(4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl]-D-tyrosinamide
Formula:C17 H23 B N4 O7
SMILES:O=C(NCB(O)O)C(NC(=O)N1C(=O)C(=O)N(CC)CC1)Cc2ccc(O)cc2
InChi:InChI=1S/C17H23BN4O7/c1-2-21-7-8-22(16(26)15(21)25)17(27)20-13(14(24)19-10-18(28)29)9-11-3-5-12(23)6-4-11/h3-6,13,23,28-29H,2,7-10H2,1H3,(H,19,24)(H,20,27)/t13-/m1/s1
Definition date:2010-07-30
Last modified:2024-09-27
Identifier:N-[(dihydroxyboranyl)methyl]-Nalpha-[(4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl]-D-tyrosinamide
CZD
CZD
Name:(8S,11S,14S)-14-{[(2S)-4-amino-2-{[2-(4-tert-butylphenyl)-4-methylpyrimidine-5-carbonyl]amino}butanoyl](methyl)amino}-3,18-bis(2-aminoethoxy)-N-[(2Z)-2-iminoethyl]-11-methyl-10,13-dioxo-9,12-diazatricyclo[13.3.1.1~2,6~]icosa-1(19),2(20),3,5,15,17-hexaene-8-carboxamide
Formula:C47 H61 N11 O7
SMILES:c1(ncc(c(n1)C)C(NC(CCN)C(N(C)C4c2cc(c(cc2)OCCN)c3c(ccc(c3)CC(NC(C(C)NC4=O)=O)C(=O)NCC=N)OCCN)=O)=O)c5ccc(C(C)(C)C)cc5
InChi:InChI=1S/C47H61N11O7/c1-27-35(26-53-41(54-27)30-8-11-32(12-9-30)47(3,4)5)43(60)56-36(15-16-48)46(63)58(6)40-31-10-14-39(65-22-19-51)34(25-31)33-23-29(7-13-38(33)64-21-18-50)24-37(44(61)52-20-17-49)57-42(59)28(2)55-45(40)62/h7-14,17,23,25-26,28,36-37,40,49H,15-16,18-22,24,48,50-51H2,1-6H3,(H,52,61)(H,55,62)(H,56,60)(H,57,59)/b49-17-/t28-,36-,37-,40-/m0/s1
Definition date:2017-10-06
Last modified:2024-09-27
Release date:2018-10-10
Identifier:(8S,11S,14S)-14-{[(2S)-4-amino-2-{[2-(4-tert-butylphenyl)-4-methylpyrimidine-5-carbonyl]amino}butanoyl](methyl)amino}-3,18-bis(2-aminoethoxy)-N-[(2Z)-2-iminoethyl]-11-methyl-10,13-dioxo-9,12-diazatricyclo[13.3.1.1~2,6~]icosa-1(19),2(20),3,5,15,17-hexaene-8-carboxamide

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數據於2025-10-22公開中

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