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SNC
SNC
Name:S-NITROSO-CYSTEINE
Formula:C3 H6 N2 O3 S
SMILES:O=C(O)C(N)CSN=O
InChi:InChI=1S/C3H6N2O3S/c4-2(3(6)7)1-9-5-8/h2H,1,4H2,(H,6,7)/t2-/m0/s1
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:S-nitroso-L-cysteine
SNM
SNM
Name:N,N-dimethyl-L-serine
Formula:C5 H11 N O3
SMILES:CN(C)[CH](CO)C(O)=O
InChi:InChI=1S/C5H11NO3/c1-6(2)4(3-7)5(8)9/h4,7H,3H2,1-2H3,(H,8,9)/t4-/m0/s1
Definition date:2017-12-12
Last modified:2023-11-03
Release date:2018-05-30
Identifier:(2~{S})-2-(dimethylamino)-3-oxidanyl-propanoic acid
SNN
SNN
Name:L-3-AMINOSUCCINIMIDE
Formula:C4 H6 N2 O2
SMILES:O=C1NC(=O)C(N)C1
InChi:InChI=1S/C4H6N2O2/c5-2-1-3(7)6-4(2)8/h2H,1,5H2,(H,6,7,8)/t2-/m0/s1
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:(3S)-3-aminopyrrolidine-2,5-dione
SOQ
SOQ
Name:N-methyl-L-aspartic acid
Formula:C5 H9 N O4
SMILES:CN[CH](CC(O)=O)C(O)=O
InChi:InChI=1S/C5H9NO4/c1-6-3(5(9)10)2-4(7)8/h3,6H,2H2,1H3,(H,7,8)(H,9,10)/t3-/m0/s1
Definition date:2020-11-26
Last modified:2023-11-03
Release date:2021-12-01
Identifier:(2~{S})-2-(methylamino)butanedioic acid
SOW
SOW
Name:[(2-amino-2-oxoethyl)amino]acetic acid
Formula:C4 H8 N2 O3
SMILES:NC(=O)CNCC(=O)O
InChi:InChI=1S/C4H8N2O3/c5-3(7)1-6-2-4(8)9/h6H,1-2H2,(H2,5,7)(H,8,9)
Definition date:2022-07-07
Last modified:2023-11-03
Release date:2022-12-07
Identifier:[(2-amino-2-oxoethyl)amino]acetic acid
8RE
8RE
Name:3,4-dihydroxylysine
Formula:C6 H14 N2 O4
SMILES:NCC[CH](O)[CH](O)[CH](N)C(O)=O
InChi:InChI=1S/C6H14N2O4/c7-2-1-3(9)5(10)4(8)6(11)12/h3-5,9-10H,1-2,7-8H2,(H,11,12)/t3-,4-,5-/m0/s1
Definition date:2017-02-28
Last modified:2023-11-03
Release date:2018-03-14
Identifier:(2~{S},3~{R},4~{S})-2,6-bis(azanyl)-3,4-bis(oxidanyl)hexanoic acid
SQ6
SQ6
Name:2,2'-azanediyldiacetic acid
Formula:C4 H7 N O4
SMILES:O=C(O)CNCC(=O)O
InChi:InChI=1S/C4H7NO4/c6-3(7)1-5-2-4(8)9/h5H,1-2H2,(H,6,7)(H,8,9)
Definition date:2022-07-07
Last modified:2023-11-03
Release date:2022-12-07
Identifier:2,2'-azanediyldiacetic acid
8SN
8SN
Name:(3~{S},7~{R},10~{R},11~{R},13~{S})-11-methyl-2-oxidanylidene-1,4-diazatricyclo[8.3.0.0^{3,7}]tridec-8-ene-13-carboxylic acid
Formula:C13 H18 N2 O3
SMILES:C[CH]1C[CH](N2[CH]1C=C[CH]3CCN[CH]3C2=O)C(O)=O
InChi:InChI=1S/C13H18N2O3/c1-7-6-10(13(17)18)15-9(7)3-2-8-4-5-14-11(8)12(15)16/h2-3,7-11,14H,4-6H2,1H3,(H,17,18)/t7-,8+,9+,10+,11+/m1/s1
Definition date:2017-03-03
Last modified:2023-11-03
Release date:2018-03-21
Identifier:(3~{S},7~{R},10~{R},11~{R},13~{S})-11-methyl-2-oxidanylidene-1,4-diazatricyclo[8.3.0.0^{3,7}]tridec-8-ene-13-carboxylic acid
SRZ
SRZ
Name:PROPOXY-L-SERINE
Formula:C6 H13 N O4
SMILES:O=C(O)C(N)COCCCO
InChi:InChI=1S/C6H13NO4/c7-5(6(9)10)4-11-3-1-2-8/h5,8H,1-4,7H2,(H,9,10)/t5-/m0/s1
Definition date:2013-11-05
Last modified:2023-11-03
Release date:2013-12-04
Identifier:O-(3-hydroxypropyl)-L-serine
STA
STA
Name:STATINE
Formula:C8 H17 N O3
SMILES:O=C(O)CC(O)C(N)CC(C)C
InChi:InChI=1S/C8H17NO3/c1-5(2)3-6(9)7(10)4-8(11)12/h5-7,10H,3-4,9H2,1-2H3,(H,11,12)/t6-,7-/m0/s1
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:(3S,4S)-4-amino-3-hydroxy-6-methylheptanoic acid
SUI
SUI
Name:(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID
Formula:C6 H8 N2 O4
SMILES:O=C1N(C(=O)CC1N)CC(=O)O
InChi:InChI=1S/C6H8N2O4/c7-3-1-4(9)8(6(3)12)2-5(10)11/h3H,1-2,7H2,(H,10,11)/t3-/m0/s1
Definition date:2001-08-20
Last modified:2023-11-03
Identifier:[(3S)-3-amino-2,5-dioxopyrrolidin-1-yl]acetic acid
SUJ
SUJ
Name:(2R,3R)-2-[(3S,6R)-3-AMINO-6-HYDROXY-2-OXOPIPERIDINYL]-3-HYDROXYBUTANOIC ACID
Formula:C9 H16 N2 O5
SMILES:O=C(O)C(N1C(=O)C(N)CCC1O)C(O)C
InChi:InChI=1S/C9H16N2O5/c1-4(12)7(9(15)16)11-6(13)3-2-5(10)8(11)14/h4-7,12-13H,2-3,10H2,1H3,(H,15,16)/t4-,5+,6-,7+/m1/s1
Definition date:2003-07-31
Last modified:2023-11-03
Identifier:(2S,3R)-2-[(3S,6R)-3-amino-6-hydroxy-2-oxopiperidin-1-yl]-3-hydroxybutanoic acid
SVA
SVA
Name:SERINE VANADATE
Formula:C3 H7 N O7 V
SMILES:[O-][V]([O-])([O-])(O)OCC(N)C(=O)O
InChi:InChI=1S/C3H6NO3.H2O.3O.V/c4-2(1-5)3(6)7
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:For multi-component charged structures, a total zero charge is required!
SWG
SWG
Name:2-[(4Z)-2-[(1R)-1-amino-2-hydroxy-ethyl]-4-(1H-indol-3-ylmethylidene)-5-oxo-imidazol-1-yl]ethanoic acid
Formula:C16 H16 N4 O4
SMILES:N[CH](CO)C1=NC(=Cc2c[nH]c3ccccc23)C(=O)N1CC(O)=O
InChi:InChI=1S/C16H16N4O4/c17-11(8-21)15-19-13(16(24)20(15)7-14(22)23)5-9-6-18-12-4-2-1-3-10(9)12/h1-6,11,18,21H,7-8,17H2,(H,22,23)/b13-5-/t11-/m0/s1
Definition date:2011-03-25
Last modified:2023-11-03
Identifier:2-[(4Z)-2-[(1R)-1-amino-2-hydroxy-ethyl]-4-(1H-indol-3-ylmethylidene)-5-oxo-imidazol-1-yl]ethanoic acid
SWW
SWW
Name:(2~{S})-2-azanyl-3-(2-hydroxyethylsulfanyl)propanoic acid
Formula:C5 H11 N O3 S
SMILES:N[CH](CSCCO)C(O)=O
InChi:InChI=1S/C5H11NO3S/c6-4(5(8)9)3-10-2-1-7/h4,7H,1-3,6H2,(H,8,9)/t4-/m1/s1
Synonyms:S-(2-hydroxyethyl)-D-cysteine
Definition date:2020-12-02
Last modified:2023-11-03
Release date:2022-01-12
Identifier:(2~{S})-2-azanyl-3-(2-hydroxyethylsulfanyl)propanoic acid
SYS
SYS
Name:3-[(2-amino-2-oxoethyl)selanyl]-L-alanine
Formula:C5 H10 N2 O3 Se
SMILES:O=C(O)C(N)C[Se]CC(=O)N
InChi:InChI=1S/C5H10N2O3Se/c6-3(5(9)10)1-11-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1
Synonyms:L-(Se-carboxamidomethyl)selenocysteine
Definition date:2008-09-17
Last modified:2023-11-03
Identifier:3-[(2-amino-2-oxoethyl)selanyl]-L-alanine
SZF
SZF
Name:1-methoxy-N-methyl-L-tryptophan
Formula:C13 H16 N2 O3
SMILES:O=C(O)C(NC)Cc1cn(OC)c2ccccc21
InChi:InChI=1S/C13H16N2O3/c1-14-11(13(16)17)7-9-8-15(18-2)12-6-4-3-5-10(9)12/h3-6,8,11,14H,7H2,1-2H3,(H,16,17)/t11-/m0/s1
Definition date:2022-07-13
Last modified:2023-11-03
Release date:2023-05-24
Identifier:1-methoxy-N-methyl-L-tryptophan
SZR
SZR
Name:(2R)-4-cyano-2-hydroxybutanoic acid
Formula:C5 H7 N O3
SMILES:O=C(O)C(O)CCC#N
InChi:InChI=1S/C5H7NO3/c6-3-1-2-4(7)5(8)9/h4,7H,1-2H2,(H,8,9)/t4-/m1/s1
Definition date:2022-07-13
Last modified:2023-11-03
Release date:2023-05-24
Identifier:(2R)-4-cyano-2-hydroxybutanoic acid
T09
T09
Name:(2S,4R)-2-amino-4-methyloctanoic acid
Formula:C9 H19 N O2
SMILES:NC(CC(C)CCCC)C(=O)O
InChi:InChI=1S/C9H19NO2/c1-3-4-5-7(2)6-8(10)9(11)12/h7-8H,3-6,10H2,1-2H3,(H,11,12)/t7-,8+/m1/s1
Definition date:2022-07-13
Last modified:2023-11-03
Release date:2023-05-24
Identifier:(2S,4R)-2-amino-4-methyloctanoic acid
92B
92B
Name:(3~{S},7~{R},10~{R},13~{S})-2-oxidanylidene-1,4-diazatricyclo[8.3.0.0^{3,7}]tridec-8-ene-13-carboxylic acid
Formula:C12 H16 N2 O3
SMILES:OC(=O)[CH]1CC[CH]2C=C[CH]3CCN[CH]3C(=O)N12
InChi:InChI=1S/C12H16N2O3/c15-11-10-7(5-6-13-10)1-2-8-3-4-9(12(16)17)14(8)11/h1-2,7-10,13H,3-6H2,(H,16,17)/t7-,8-,9-,10-/m0/s1
Definition date:2017-04-03
Last modified:2023-11-03
Release date:2017-06-14
Identifier:(3~{S},7~{R},10~{R},13~{S})-2-oxidanylidene-1,4-diazatricyclo[8.3.0.0^{3,7}]tridec-8-ene-13-carboxylic acid
T17
T17
Name:{[4-(1-{3-[(3aS,4R,7R,9R,10R,11R,13R,15R,15aR)-10-{[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-4-ethyl-11-methoxy-3a,7,9,11,13,15-hexamethyl-2,6,8,14-tetraoxododecahydro-2H-oxacyclotetradecino[4,3-d][1,3]oxazol-1(4H)-yl]propyl}-1H-1,2,3-triazol-4-yl)butanoyl]amino}acetic acid
Formula:C42 H68 N6 O13
SMILES:O=C(O)CNC(=O)CCCc1nnn(c1)CCCN3C(=O)OC4(C(OC(=O)C(C(=O)C(C(OC2OC(C)CC(N(C)C)C2O)C(OC)(C)CC(C(=O)C(C)C34)C)C)C)CC)C
InChi:InChI=1S/C42H68N6O13/c1-12-30-42(8)36(48(40(56)61-42)18-14-17-47-22-28(44-45-47)15-13-16-31(49)43-21-32(50)51)25(4)33(52)23(2)20-41(7,57-11)37(26(5)34(53)27(6)38(55)59-30)60-39-35(54)29(46(9)10)19-24(3)58-39/h22-27,29-30,35-37,39,54H,12-21H2,1-11H3,(H,43,49)(H,50,51)/t23-,24-,25+,26+,27-,29+,30-,35-,36-,37-,39+,41-,42-/m1/s1
Definition date:2014-05-10
Last modified:2023-11-03
Release date:2014-10-01
Identifier:{[4-(1-{3-[(3aS,4R,7R,9R,10R,11R,13R,15R,15aR)-10-{[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-4-ethyl-11-methoxy-3a,7,9,11,13,15-hexamethyl-2,6,8,14-tetraoxododecahydro-2H-oxacyclotetradecino[4,3-d][1,3]oxazol-1(4H)-yl]propyl}-1H-1,2,3-triazol-4-yl)butanoyl]amino}acetic acid (non-preferred name)
T1F
T1F
Name:(4R)-1-[1-[(S)-[1-cyclopentyl-3-(2-methylphenyl)pyrazol-4-yl]-(4-methylphenyl)methyl]-2-oxidanylidene-pyridin-3-yl]-3-methyl-2-oxidanylidene-N-(3-oxidanylidene-2-azabicyclo[2.2.2]octan-4-yl)imidazolidine-4-carboxamide
Formula:C40 H45 N7 O4
SMILES:CN1[CH](CN(C1=O)C2=CC=CN([CH](c3ccc(C)cc3)c4cn(nc4c5ccccc5C)C6CCCC6)C2=O)C(=O)NC78CCC(CC7)NC8=O
InChi:InChI=1S/C40H45N7O4/c1-25-14-16-27(17-15-25)35(31-23-47(29-10-5-6-11-29)43-34(31)30-12-7-4-9-26(30)2)45-22-8-13-32(37(45)49)46-24-33(44(3)39(46)51)36(48)42-40-20-18-28(19-21-40)41-38(40)50/h4,7-9,12-17,22-23,28-29,33,35H,5-6,10-11,18-21,24H2,1-3H3,(H,41,50)(H,42,48)/t28-,33-,35+,40-/m1/s1
Definition date:2023-04-19
Last modified:2023-11-03
Release date:2023-11-08
Identifier:(4~{R})-1-[1-[(~{S})-[1-cyclopentyl-3-(2-methylphenyl)pyrazol-4-yl]-(4-methylphenyl)methyl]-2-oxidanylidene-pyridin-3-yl]-3-methyl-2-oxidanylidene-~{N}-(3-oxidanylidene-2-azabicyclo[2.2.2]octan-4-yl)imidazolidine-4-carboxamide
ABA
ABA
Name:ALPHA-AMINOBUTYRIC ACID
Formula:C4 H9 N O2
SMILES:O=C(O)C(N)CC
InChi:InChI=1S/C4H9NO2/c1-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m0/s1
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:(2S)-2-aminobutanoic acid
ABN
ABN
Name:BENZYLAMINE
Formula:C7 H9 N
SMILES:NCc1ccccc1
InChi:InChI=1S/C7H9N/c8-6-7-4-2-1-3-5-7/h1-5H,6,8H2
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:1-phenylmethanamine
ABU
ABU
Name:GAMMA-AMINO-BUTANOIC ACID
Formula:C4 H9 N O2
SMILES:O=C(O)CCCN
InChi:InChI=1S/C4H9NO2/c5-3-1-2-4(6)7/h1-3,5H2,(H,6,7)
Synonyms:GAMMA(AMINO)-BUTYRIC ACID
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:4-aminobutanoic acid

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