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AR7

AR7
Name:	amino{[(4S)-4-amino-5,5-dihydroxypentyl]amino}methaniminium
Formula:	C6 H17 N4 O2
SMILES:	OC(O)C(N)CCCNC(=[NH2+])N
InChi:	InChI=1S/C6H16N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4-5,11-12H,1-3,7H2,(H4,8,9,10)/p+1/t4-/m0/s1
Definition date:	2010-09-24
Last modified:	2024-09-27
Identifier:	amino{[(4S)-4-amino-5,5-dihydroxypentyl]amino}methaniminium

ARA

ARA
Name:	alpha-L-arabinopyranose
Formula:	C5 H10 O5
SMILES:	OC1C(O)COC(O)C1O
InChi:	InChI=1S/C5H10O5/c6-2-1-10-5(9)4(8)3(2)7/h2-9H,1H2/t2-,3-,4+,5+/m0/s1
Synonyms:	alpha-L-arabinose
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	alpha-L-arabinopyranose

ASL

ASL
Name:	ASPARTIC ACID-4-CARBOXYETHYL ESTER
Formula:	C7 H11 N O6
SMILES:	O=C(OC(C(=O)O)C)CC(C(=O)O)N
InChi:	InChI=1S/C7H11NO6/c1-3(6(10)11)14-5(9)2-4(8)7(12)13/h3-4H,2,8H2,1H3,(H,10,11)(H,12,13)
Definition date:	1999-09-09
Last modified:	2024-09-27
Identifier:	2-amino-4-(1-carboxyethoxy)-4-oxobutanoic acid (non-preferred name)

AVH

AVH
Name:	(1R,2R,4R)-4-ethenylcyclohexane-1,2-diol
Formula:	C8 H14 O2
SMILES:	C1(CCC(C=C)CC1O)O
InChi:	InChI=1S/C8H14O2/c1-2-6-3-4-7(9)8(10)5-6/h2,6-10H,1,3-5H2/t6-,7?,8-/m1/s1
Definition date:	2016-11-11
Last modified:	2024-09-27
Release date:	2017-10-11
Identifier:	(1R,2R,4R)-4-ethenylcyclohexane-1,2-diol

AVU

AVU
Name:	[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl [(2R,3R,4R)-4-fluoro-3-hydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate
Formula:	C15 H22 F N5 O12 P2
SMILES:	FC1C(O)C(OC1)COP(=O)(O)OP(=O)(O)OCC4OC(n3cnc2c(ncnc23)N)C(O)C4O
InChi:	InChI=1S/C15H22FN5O12P2/c16-6-1-29-7(10(6)22)2-30-34(25,26)33-35(27,28)31-3-8-11(23)12(24)15(32-8)21-5-20-9-13(17)18-4-19-14(9)21/h4-8,10-12,15,22-24H,1-3H2,(H,25,26)(H,27,28)(H2,17,18,19)/t6-,7-,8-,10+,11-,12-,15-/m1/s1
Synonyms:	arabinosyl-2-fluoro-deoxy-adenosine diphosphate ribose, ara-2'F-ADPR
Definition date:	2009-07-14
Last modified:	2024-09-27
Identifier:	[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl [(2R,3R,4R)-4-fluoro-3-hydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate (non-preferred name)

AVY

AVY
Name:	(1R,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(S(O)(=O)=O)O)NC(C(CC(C)C)NC(=O)OC3(Cc2ccccc2)CCN(CC3)C(=O)OC(C)(C)C)=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
Synonyms:	bound form
Definition date:	2017-07-28
Last modified:	2024-09-27
Release date:	2018-04-04
Identifier:	(1R,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

AW4

AW4
Name:	(1S,2S)-2-[(N-{[2-(3-chlorophenyl)ethoxy]carbonyl}-L-leucyl)amino]-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid
Formula:	C22 H32 Cl N3 O8 S
SMILES:	C1(=O)NCCC1CC(NC(C(NC(=O)OCCc2cccc(c2)Cl)CC(C)C)=O)C(O)S(O)(=O)=O
InChi:	InChI=1S/C22H32ClN3O8S/c1-13(2)10-17(26-22(30)34-9-7-14-4-3-5-16(23)11-14)20(28)25-18(21(29)35(31,32)33)12-15-6-8-24-19(15)27/h3-5,11,13,15,17-18,21,29H,6-10,12H2,1-2H3,(H,24,27)(H,25,28)(H,26,30)(H,31,32,33)/t15-,17-,18-,21-/m0/s1
Synonyms:	bound form
Definition date:	2017-07-28
Last modified:	2024-09-27
Release date:	2018-04-04
Identifier:	(1S,2S)-2-[(N-{[2-(3-chlorophenyl)ethoxy]carbonyl}-L-leucyl)amino]-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid

DOA

DOA
Name:	12-AMINO-DODECANOIC ACID
Formula:	C12 H25 N O2
SMILES:	O=C(O)CCCCCCCCCCCN
InChi:	InChI=1S/C12H25NO2/c13-11-9-7-5-3-1-2-4-6-8-10-12(14)15/h1-11,13H2,(H,14,15)
Definition date:	2000-03-31
Last modified:	2024-09-27
Identifier:	12-aminododecanoic acid

DP7

DP7
Name:	AC-(D)PHE-PRO-BOROARG-OH
Formula:	C21 H33 B N6 O5
SMILES:	O=C(NC(B(O)O)CCCNC(=[N@H])N)C2N(C(=O)C(NC(=O)C)Cc1ccccc1)CCC2
InChi:	InChI=1S/C21H33BN6O5/c1-14(29)26-16(13-15-7-3-2-4-8-15)20(31)28-12-6-9-17(28)19(30)27-18(22(32)33)10-5-11-25-21(23)24/h2-4,7-8,16-18,32-33H,5-6,9-13H2,1H3,(H,26,29)(H,27,30)(H4,23,24,25)/t16-,17+,18+/m1/s1
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	N-acetyl-D-phenylalanyl-N-[(1R)-4-carbamimidamido-1-(dihydroxyboranyl)butyl]-L-prolinamide

DPN

DPN
Name:	D-PHENYLALANINE
Formula:	C9 H11 N O2
SMILES:	O=C(O)C(N)Cc1ccccc1
InChi:	InChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m1/s1
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	D-phenylalanine

DQK

DQK
Name:	(2~{S})-4-[[(5~{S})-5-azanyl-6-oxidanylidene-hexyl]amino]-2-naphthalen-2-ylsulfanyl-4-oxidanylidene-butanoic acid
Formula:	C20 H24 N2 O4 S
SMILES:	N[CH](CCCCNC(=O)C[CH](Sc1ccc2ccccc2c1)C(O)=O)C=O
InChi:	InChI=1S/C20H24N2O4S/c21-16(13-23)7-3-4-10-22-19(24)12-18(20(25)26)27-17-9-8-14-5-1-2-6-15(14)11-17/h1-2,5-6,8-9,11,13,16,18H,3-4,7,10,12,21H2,(H,22,24)(H,25,26)/t16-,18-/m0/s1
Definition date:	2018-01-26
Last modified:	2024-09-27
Release date:	2018-04-18
Identifier:	(2~{S})-4-[[(5~{S})-5-azanyl-6-oxidanylidene-hexyl]amino]-2-naphthalen-2-ylsulfanyl-4-oxidanylidene-butanoic acid

DQL

DQL
Name:	2-azanyl-6-sulfanyl-1,3-benzothiazol-4-ol
Formula:	C7 H6 N2 O S2
SMILES:	Nc1sc2cc(S)cc(O)c2n1
InChi:	InChI=1S/C7H6N2OS2/c8-7-9-6-4(10)1-3(11)2-5(6)12-7/h1-2,10-11H,(H2,8,9)
Definition date:	2019-08-22
Last modified:	2024-09-27
Release date:	2020-09-02
Identifier:	2-azanyl-6-sulfanyl-1,3-benzothiazol-4-ol

DRZ

DRZ
Name:	3',4'-DIHYDROXY-PENTANAL-5'-PHOSPHATE
Formula:	C5 H11 O7 P
SMILES:	O=P(O)(O)OCC(O)C(O)CC=O
InChi:	InChI=1S/C5H11O7P/c6-2-1-4(7)5(8)3-12-13(9,10)11/h2,4-5,7-8H,1,3H2,(H2,9,10,11)/t4-,5+/m0/s1
Definition date:	2002-07-18
Last modified:	2024-09-27
Identifier:	2-deoxy-5-O-phosphono-D-erythro-pentose

DSB

DSB
Name:	4,7-DIOXOSEBACIC ACID
Formula:	C10 H14 O6
SMILES:	O=C(CCC(=O)CCC(=O)O)CCC(=O)O
InChi:	InChI=1S/C10H14O6/c11-7(3-5-9(13)14)1-2-8(12)4-6-10(15)16/h1-6H2,(H,13,14)(H,15,16)
Definition date:	2001-03-19
Last modified:	2024-09-27
Identifier:	4,7-dioxodecanedioic acid

DT
Name:	THYMIDINE-5'-MONOPHOSPHATE
Formula:	C10 H15 N2 O8 P
SMILES:	O=C1NC(=O)N(C=C1C)C2OC(C(O)C2)COP(=O)(O)O
InChi:	InChI=1S/C10H15N2O8P/c1-5-3-12(10(15)11-9(5)14)8-2-6(13)7(20-8)4-19-21(16,17)18/h3,6-8,13H,2,4H2,1H3,(H,11,14,15)(H2,16,17,18)/t6-,7+,8+/m0/s1
Definition date:	2006-12-05
Last modified:	2024-09-27
Identifier:	5'-thymidylic acid

DT6

DT6
Name:	2,4-bisacetamido-2,4-dideoxy-beta-D-glucopyranose
Formula:	C10 H18 N2 O6
SMILES:	O=C(NC1C(OC(O)C(NC(=O)C)C1O)CO)C
InChi:	InChI=1S/C10H18N2O6/c1-4(14)11-7-6(3-13)18-10(17)8(9(7)16)12-5(2)15/h6-10,13,16-17H,3H2,1-2H3,(H,11,14)(H,12,15)/t6-,7-,8-,9+,10-/m1/s1
Synonyms:	2,4-bis(acetylamino)-2,4-dideoxy-beta-D-glucopyranose
Definition date:	2006-06-29
Last modified:	2024-09-27
Identifier:	2,4-bis(acetylamino)-2,4-dideoxy-beta-D-glucopyranose

DTU

DTU
Name:	(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-DIOL
Formula:	C4 H10 O2 S2
SMILES:	SCC(O)C(O)CS
InChi:	InChI=1S/C4H10O2S2/c5-3(1-7)4(6)2-8/h3-8H,1-2H2/t3-,4+
Definition date:	2004-06-18
Last modified:	2024-09-27
Identifier:	(2R,3S)-1,4-disulfanylbutane-2,3-diol

DTV

DTV
Name:	(2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-DIOL
Formula:	C4 H10 O2 S2
SMILES:	SCC(O)C(O)CS
InChi:	InChI=1S/C4H10O2S2/c5-3(1-7)4(6)2-8/h3-8H,1-2H2/t3-,4-/m1/s1
Definition date:	2004-06-18
Last modified:	2024-09-27
Identifier:	(2S,3S)-1,4-disulfanylbutane-2,3-diol

DU1

DU1
Name:	4-{[3-(8-cyclohexyl-2,6-dioxo-1-propyl-1,2,6,7-tetrahydro-3H-purin-3-yl)propyl]carbamoyl}benzene-1-sulfonyl fluoride
Formula:	C24 H30 F N5 O5 S
SMILES:	O=C3N(CCCNC(=O)c1ccc(cc1)S(=O)(F)=O)c2nc(nc2C(N3CCC)=O)C4CCCCC4
InChi:	InChI=1S/C24H30FN5O5S/c1-2-14-30-23(32)19-21(28-20(27-19)16-7-4-3-5-8-16)29(24(30)33)15-6-13-26-22(31)17-9-11-18(12-10-17)36(25,34)35/h9-12,16H,2-8,13-15H2,1H3,(H,26,31)(H,27,28)
Definition date:	2017-01-12
Last modified:	2024-09-27
Release date:	2017-03-01
Identifier:	4-{[3-(8-cyclohexyl-2,6-dioxo-1-propyl-1,2,6,7-tetrahydro-3H-purin-3-yl)propyl]carbamoyl}benzene-1-sulfonyl fluoride

DUG

DUG
Name:	(3-chloro-4-fluorophenoxy)acetaldehyde
Formula:	C8 H6 Cl F O3
SMILES:	Fc1ccc(cc1Cl)OCC=O
InChi:	InChI=1S/C8H6ClFO3/c9-6-3-5(1-2-7(6)10)13-4-8(11)12/h1-3H,4H2,(H,11,12)
Definition date:	2017-11-07
Last modified:	2024-09-27
Release date:	2018-10-17
Identifier:	(3-chloro-4-fluorophenoxy)acetaldehyde

DUV

DUV
Name:	(2R)-2-methanoylhept-6-ynoic acid
Formula:	C8 H10 O3
SMILES:	OC(=O)[CH](CCCC#C)C=O
InChi:	InChI=1S/C8H10O3/c1-2-3-4-5-7(6-9)8(10)11/h1,6-7H,3-5H2,(H,10,11)/t7-/m1/s1
Definition date:	2017-09-21
Last modified:	2024-09-27
Release date:	2018-05-23
Identifier:	(2~{R})-2-methanoylhept-6-ynoic acid

DUW

DUW
Name:	(2R)-2-methanoyl-3-phenyl-propanoic acid
Formula:	C10 H10 O3
SMILES:	OC(=O)[CH](Cc1ccccc1)C=O
InChi:	InChI=1S/C10H10O3/c11-7-9(10(12)13)6-8-4-2-1-3-5-8/h1-5,7,9H,6H2,(H,12,13)/t9-/m1/s1
Definition date:	2017-09-21
Last modified:	2024-09-27
Release date:	2018-05-23
Identifier:	(2~{R})-2-methanoyl-3-phenyl-propanoic acid

DV6

DV6
Name:	[(2S)-3-[(2S)-2-(disulfanyl)-2,3-dihydro-1H-imidazol-4-yl]-1-oxidanyl-1-oxidanylidene-propan-2-yl]-trimethyl-azanium
Formula:	C9 H18 N3 O2 S2
SMILES:	C[N+](C)(C)[CH](CC1=CN[CH](N1)SS)C(O)=O
InChi:	InChI=1S/C9H17N3O2S2/c1-12(2,3)7(8(13)14)4-6-5-10-9(11-6)16-15/h5,7,9-11H,4H2,1-3H3,(H-,13,14,15)/p+1/t7-,9-/m0/s1
Definition date:	2019-09-03
Last modified:	2024-09-27
Release date:	2020-08-26
Identifier:	[(2~{S})-3-[(2~{S})-2-(disulfanyl)-2,3-dihydro-1~{H}-imidazol-4-yl]-1-oxidanyl-1-oxidanylidene-propan-2-yl]-trimethyl-azanium

DV7

DV7
Name:	L-(7-hydroxycoumarin-4-yl)ethylglycine
Formula:	C13 H13 N O5
SMILES:	C(C(CCC=2c1ccc(O)cc1OC(C=2)=O)N)(=O)O
InChi:	InChI=1S/C13H13NO5/c14-10(13(17)18)4-1-7-5-12(16)19-11-6-8(15)2-3-9(7)11/h2-3,5-6,10,15H,1,4,14H2,(H,17,18)/t10-/m0/s1
Synonyms:	(2S)-2-amino-4-(7-hydroxy-2-oxo-2H-1-benzopyran-4-yl)butanoic acid
Definition date:	2017-11-09
Last modified:	2024-09-27
Release date:	2018-11-14
Identifier:	(2S)-2-amino-4-(7-hydroxy-2-oxo-2H-1-benzopyran-4-yl)butanoic acid

DV9

DV9
Name:	(2S)-2-azanyl-6,6-bis(fluoranyl)-5-oxidanylidene-6-phosphono-hexanoic acid
Formula:	C6 H10 F2 N O6 P
SMILES:	N[CH](CCC(=O)C(F)(F)[P](O)(O)=O)C(O)=O
InChi:	InChI=1S/C6H10F2NO6P/c7-6(8,16(13,14)15)4(10)2-1-3(9)5(11)12/h3H,1-2,9H2,(H,11,12)(H2,13,14,15)/t3-/m0/s1
Definition date:	2019-09-06
Last modified:	2024-09-27
Release date:	2021-09-08
Identifier:	(2~{S})-2-azanyl-6,6-bis(fluoranyl)-5-oxidanylidene-6-phosphono-hexanoic acid

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