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DI5
DI5
Name:AC-(D)PHE-PRO-BOROHOMOORNITHINE-OH
Formula:C20 H31 B N4 O5
SMILES:O=C(NC(B(O)O)CCCN)C2N(C(=O)C(NC(=O)C)Cc1ccccc1)CCC2
InChi:InChI=1S/C20H31BN4O5/c1-14(26)23-16(13-15-7-3-2-4-8-15)20(28)25-12-6-9-17(25)19(27)24-18(21(29)30)10-5-11-22/h2-4,7-8,16-18,29-30H,5-6,9-13,22H2,1H3,(H,23,26)(H,24,27)/t16-,17+,18+/m1/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:N-acetyl-D-phenylalanyl-N-[(1R)-4-amino-1-(dihydroxyboranyl)butyl]-L-prolinamide
DI7
DI7
Name:2,6-dimethyl-L-tyrosine
Formula:C11 H15 N O3
SMILES:O=C(O)C(N)Cc1c(cc(O)cc1C)C
InChi:InChI=1S/C11H15NO3/c1-6-3-8(13)4-7(2)9(6)5-10(12)11(14)15/h3-4,10,13H,5,12H2,1-2H3,(H,14,15)/t10-/m0/s1
Definition date:2014-12-10
Last modified:2024-09-27
Release date:2015-01-14
Identifier:2,6-dimethyl-L-tyrosine
DI8
DI8
Name:(3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
Formula:C10 H11 N O2
SMILES:O=C(O)C2NCc1ccccc1C2
InChi:InChI=1S/C10H11NO2/c12-10(13)9-5-7-3-1-2-4-8(7)6-11-9/h1-4,9,11H,5-6H2,(H,12,13)/t9-/m0/s1
Definition date:2014-12-10
Last modified:2024-09-27
Release date:2015-01-14
Identifier:(3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
DIB
DIB
Name:3-AMINO-(DIMETHYLPROPYLAMINE)
Formula:C5 H14 N2
SMILES:NCCCN(C)C
InChi:InChI=1S/C5H14N2/c1-7(2)5-3-4-6/h3-6H2,1-2H3
Definition date:2002-08-08
Last modified:2024-09-27
Identifier:N,N-dimethylpropane-1,3-diamine
DIC
DIC
Name:3,4-DICHLOROISOCOUMARIN
Formula:C9 H4 Cl2 O2
SMILES:ClC=1OC(=O)c2ccccc2C=1Cl
InChi:InChI=1S/C9H4Cl2O2/c10-7-5-3-1-2-4-6(5)9(12)13-8(7)11/h1-4H
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:3,4-dichloro-1H-isochromen-1-one
DIK
DIK
Name:5-{[4-(5-methyl-3-oxohex-4-en-1-yl)phenyl]amino}-5-oxopentanoic acid
Formula:C18 H23 N O4
SMILES:O=C(O)CCCC(=O)Nc1ccc(cc1)CCC(=O)C=C(/C)C
InChi:InChI=1S/C18H23NO4/c1-13(2)12-16(20)11-8-14-6-9-15(10-7-14)19-17(21)4-3-5-18(22)23/h6-7,9-10,12H,3-5,8,11H2,1-2H3,(H,19,21)(H,22,23)
Definition date:2008-12-31
Last modified:2024-09-27
Identifier:5-{[4-(5-methyl-3-oxohex-4-en-1-yl)phenyl]amino}-5-oxopentanoic acid
DIP
DIP
Name:DIPENTYLAMINE
Formula:C10 H23 N
SMILES:N(CCCCC)CCCCC
InChi:InChI=1S/C10H23N/c1-3-5-7-9-11-10-8-6-4-2/h11H,3-10H2,1-2H3
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:N-pentylpentan-1-amine
DIV
DIV
Name:D-ISOVALINE
Formula:C5 H11 N O2
SMILES:O=C(O)C(N)(C)CC
InChi:InChI=1S/C5H11NO2/c1-3-5(2,6)4(7)8/h3,6H2,1-2H3,(H,7,8)/t5-/m1/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:D-isovaline
DIX
DIX
Name:METHYL(CYCLOPENTYL-PROPYL)AMINE
Formula:C9 H19 N
SMILES:N(CCCC1CCCC1)C
InChi:InChI=1S/C9H19N/c1-10-8-4-7-9-5-2-3-6-9/h9-10H,2-8H2,1H3
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:3-cyclopentyl-N-methylpropan-1-amine
DIY
DIY
Name:5-BUTYLPIPERIDINE
Formula:C9 H19 N
SMILES:N1CCCC(CCCC)C1
InChi:InChI=1S/C9H19N/c1-2-3-5-9-6-4-7-10-8-9/h9-10H,2-8H2,1H3/t9-/m1/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:(3R)-3-butylpiperidine
DJ5
DJ5
Name:N~3~-{(2R)-4-[(dihydroxyphosphanyl)oxy]-2-hydroxy-3,3-dimethylbutanoyl}-N-(2-{[(9Z)-hexadec-9-enoyl]amino}ethyl)-beta-alaninamide
Formula:C27 H52 N3 O8 P
SMILES:O=P(O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCNC(=O)CCCCCCC/C=CCCCCCC
InChi:InChI=1S/C27H52N3O8P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(31)28-20-21-29-24(32)18-19-30-26(34)25(33)27(2,3)22-38-39(35,36)37/h9-10,25,33H,4-8,11-22H2,1-3H3,(H,28,31)(H,29,32)(H,30,34)(H2,35,36,37)/b10-9-/t25-/m0/s1
Definition date:2021-11-30
Last modified:2024-09-27
Release date:2022-11-23
Identifier:N-(2-{[(9Z)-hexadec-9-enoyl]amino}ethyl)-N~3~-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alaninamide
DJD
DJD
Name:4-(6-methyl-1,2,4,5-tetrazin-3-yl)-L-phenylalanine
Formula:C12 H13 N5 O2
SMILES:NC(Cc1ccc(cc1)c2nnc(C)nn2)C(O)=O
InChi:InChI=1S/C12H13N5O2/c1-7-14-16-11(17-15-7)9-4-2-8(3-5-9)6-10(13)12(18)19/h2-5,10H,6,13H2,1H3,(H,18,19)/t10-/m0/s1
Definition date:2017-10-26
Last modified:2024-09-27
Release date:2019-10-02
Identifier:4-(6-methyl-1,2,4,5-tetrazin-3-yl)-L-phenylalanine
DJK
DJK
Name:N-[4-(3-BROMO-PHENYLAMINO)-QUINAZOLIN-6-YL]-ACRYLAMIDE
Formula:C17 H13 Br N4 O
SMILES:Brc1cccc(c1)Nc3ncnc2c3cc(cc2)NC(=O)C=C
InChi:InChI=1S/C17H13BrN4O/c1-2-16(23)21-13-6-7-15-14(9-13)17(20-10-19-15)22-12-5-3-4-11(18)8-12/h2-10H,1H2,(H,21,23)(H,19,20,22)
Definition date:2006-08-02
Last modified:2024-09-27
Identifier:N-{4-[(3-bromophenyl)amino]quinazolin-6-yl}prop-2-enamide
DJT
DJT
Name:(2S,4R)-4-(2-chlorophenyl)sulfonyl-1-[1-(4-fluorophenyl)cyclopropyl]carbonyl-N-[1-(iminomethyl)cyclopropyl]pyrrolidine-2-carboxamide
Formula:C25 H25 Cl F N3 O4 S
SMILES:O=S(=O)(c1ccccc1Cl)C5CC(C(=O)NC2(C=[N@H])CC2)N(C(=O)C4(c3ccc(F)cc3)CC4)C5
InChi:InChI=1S/C25H25ClFN3O4S/c26-19-3-1-2-4-21(19)35(33,34)18-13-20(22(31)29-24(15-28)9-10-24)30(14-18)23(32)25(11-12-25)16-5-7-17(27)8-6-16/h1-8,15,18,20,28H,9-14H2,(H,29,31)/b28-15+/t18-,20+/m1/s1
Definition date:2010-10-15
Last modified:2024-09-27
Identifier:(4R)-4-[(2-chlorophenyl)sulfonyl]-1-{[1-(4-fluorophenyl)cyclopropyl]carbonyl}-N-{1-[(E)-iminomethyl]cyclopropyl}-L-prolinamide
DKA
DKA
Name:DECANOIC ACID
Formula:C10 H20 O2
SMILES:O=C(O)CCCCCCCCC
InChi:InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)
Definition date:2000-07-17
Last modified:2024-09-27
Identifier:decanoic acid
DLE
DLE
Name:D-LEUCINE
Formula:C6 H13 N O2
SMILES:O=C(O)C(N)CC(C)C
InChi:InChI=1S/C6H13NO2/c1-4(2)3-5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t5-/m1/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:D-leucine
DLS
DLS
Name:DI-ACETYL-LYSINE
Formula:C10 H18 N2 O4
SMILES:O=C(NC(C(=O)O)CCCCNC(=O)C)C
InChi:InChI=1S/C10H18N2O4/c1-7(13)11-6-4-3-5-9(10(15)16)12-8(2)14/h9H,3-6H2,1-2H3,(H,11,13)(H,12,14)(H,15,16)/t9-/m0/s1
Definition date:2000-10-11
Last modified:2024-09-27
Identifier:N~2~,N~6~-diacetyl-L-lysine
DM0
DM0
Name:N~2~,N~2~,N~6~,N~6~-tetramethyl-L-lysine
Formula:C10 H22 N2 O2
SMILES:O=C(O)C(N(C)C)CCCCN(C)C
InChi:InChI=1S/C10H22N2O2/c1-11(2)8-6-5-7-9(10(13)14)12(3)4/h9H,5-8H2,1-4H3,(H,13,14)/t9-/m0/s1
Definition date:2008-03-25
Last modified:2024-09-27
Identifier:N~2~,N~2~,N~6~,N~6~-tetramethyl-L-lysine
DMG
DMG
Name:N,N-DIMETHYLGLYCINE
Formula:C4 H9 N O2
SMILES:O=C(O)CN(C)C
InChi:InChI=1S/C4H9NO2/c1-5(2)3-4(6)7/h3H2,1-2H3,(H,6,7)
Synonyms:DIMETHYLGLYCINE
Definition date:2000-03-20
Last modified:2024-09-27
Identifier:N,N-dimethylglycine
DMH
DMH
Name:N4,N4-DIMETHYL-ASPARAGINE
Formula:C6 H12 N2 O3
SMILES:O=C(N(C)C)CC(N)C(=O)O
InChi:InChI=1S/C6H12N2O3/c1-8(2)5(9)3-4(7)6(10)11/h4H,3,7H2,1-2H3,(H,10,11)/t4-/m0/s1
Definition date:2001-08-24
Last modified:2024-09-27
Identifier:N,N-dimethyl-L-asparagine
DMK
DMK
Name:3,3-DIMETHYL ASPARTIC ACID
Formula:C6 H11 N O4
SMILES:NC(C(C(O)=O)(C)C)C(=O)O
InChi:InChI=1S/C6H11NO4/c1-6(2,5(10)11)3(7)4(8)9/h3H,7H2,1-2H3,(H,8,9)(H,10,11)/t3-/m1/s1
Definition date:2003-01-30
Last modified:2024-09-27
Identifier:3,3-dimethyl-L-aspartic acid
DMO
DMO
Name:ALPHA-DIFLUOROMETHYLORNITHINE
Formula:C6 H12 F2 N2 O2
SMILES:FC(F)C(N)(C(=O)O)CCCN
InChi:InChI=1S/C6H12F2N2O2/c7-4(8)6(10,5(11)12)2-1-3-9/h4H,1-3,9-10H2,(H,11,12)/t6-/m1/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:2-(difluoromethyl)-L-ornithine
DMS
DMS
Name:DIMETHYL SULFOXIDE
Formula:C2 H6 O S
SMILES:sulfinyldimethane
InChi:InChI=1S/C2H6OS/c1-4(2)3/h1-2H3
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:dimethyl sulfoxide
DMT
DMT
Name:3-HYDROXY-4,4-DIMETHYL-2-(METHYLAMINO)-6-OCTENOIC ACID
Formula:C11 H21 N O3
SMILES:O=C(O)C(NC)C(O)C(C/C=C/C)(C)C
InChi:InChI=1S/C11H21NO3/c1-5-6-7-11(2,3)9(13)8(12-4)10(14)15/h5-6,8-9,12-13H,7H2,1-4H3,(H,14,15)/b6-5+/t8-,9-/m0/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:4-[(2E)-but-2-en-1-yl]-2,4,5-trideoxy-4-methyl-2-(methylamino)-D-arabinonic acid
DN1
DN1
Name:3-({(2S)-2-[({(1R)-1-[({(1R)-1-[(R)-CARBOXY(HYDROXY)METHYL]-3,3-DIFLUOROPROPYL}AMINO)CARBONYL]-3-METHYLBUTYL}AMINO)CARB ONYL]-2,3-DIHYDRO-1H-INDOL-2-YL}METHYL)THIOPHENE-2-CARBOXYLIC ACID
Formula:C26 H31 F2 N3 O7 S
SMILES:O=C(O)C(O)C(NC(=O)C(NC(=O)C2(Nc1ccccc1C2)Cc3c(scc3)C(=O)O)CC(C)C)CC(F)F
InChi:InChI=1S/C26H31F2N3O7S/c1-13(2)9-18(22(33)29-17(10-19(27)28)20(32)23(34)35)30-25(38)26(11-14-5-3-4-6-16(14)31-26)12-15-7-8-39-21(15)24(36)37/h3-8,13,17-20,31-32H,9-12H2,1-2H3,(H,29,33)(H,30,38)(H,34,35)(H,36,37)/t17-,18-,20-,26+/m1/s1
Synonyms:PEPTIDOMIMETIC INHIBITOR
Definition date:2004-07-14
Last modified:2024-09-27
Identifier:3-{[N-({(2S)-2-[(2-carboxythiophen-3-yl)methyl]-2,3-dihydro-1H-indol-2-yl}carbonyl)-D-leucyl]amino}-3,4,5-trideoxy-5,5-difluoro-D-erythro-pentonic acid

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数据于2025-10-15公开中

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