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BJF

BJF
Name:	{2-[(1S)-1-amino-3-methylbutyl]-5-hydroxy-4-(2-methylpropyl)-1H-imidazol-1-yl}acetic acid
Formula:	C14 H25 N3 O3
SMILES:	Oc1c(CC(C)C)nc(C(N)CC(C)C)n1CC(O)=O
InChi:	InChI=1S/C14H25N3O3/c1-8(2)5-10(15)13-16-11(6-9(3)4)14(20)17(13)7-12(18)19/h8-10,20H,5-7,15H2,1-4H3,(H,18,19)/t10-/m0/s1
Synonyms:	CHROMOPHORE (LEU-LEU-GLY)
Definition date:	2019-02-06
Last modified:	2024-09-27
Release date:	2019-03-20
Identifier:	{2-[(1S)-1-amino-3-methylbutyl]-5-hydroxy-4-(2-methylpropyl)-1H-imidazol-1-yl}acetic acid

BJH

BJH
Name:	1(R)-1-ACETAMIDO-2-(3-CARBOXY-2-HYDROXYPHENYL)ETHYL BORONIC ACID
Formula:	C11 H14 B N O6
SMILES:	O=C(O)c1cccc(c1O)CC(B(O)O)NC(=O)C
InChi:	InChI=1S/C11H14BNO6/c1-6(14)13-9(12(18)19)5-7-3-2-4-8(10(7)15)11(16)17/h2-4,9,15,18-19H,5H2,1H3,(H,13,14)(H,16,17)/t9-/m0/s1
Definition date:	2000-04-20
Last modified:	2024-09-27
Identifier:	3-[(2R)-2-(acetylamino)-2-(dihydroxyboranyl)ethyl]-2-hydroxybenzoic acid

BJI

BJI
Name:	1(R)-1-ACETAMIDO-2-(3-CARBOXYPHENYL)ETHYL BORONIC ACID
Formula:	C11 H14 B N O5
SMILES:	O=C(O)c1cc(ccc1)CC(NC(=O)C)B(O)O
InChi:	InChI=1S/C11H14BNO5/c1-7(14)13-10(12(17)18)6-8-3-2-4-9(5-8)11(15)16/h2-5,10,17-18H,6H2,1H3,(H,13,14)(H,15,16)/t10-/m0/s1
Definition date:	2000-04-17
Last modified:	2024-09-27
Identifier:	3-[(2R)-2-(acetylamino)-2-(dihydroxyboranyl)ethyl]benzoic acid

BJL

BJL
Name:	N-[(3R)-4-ethoxy-3-hydroxy-4-oxobutanoyl]-L-tyrosine
Formula:	C15 H19 N O7
SMILES:	C(c1ccc(cc1)O)C(C(O)=O)NC(CC(O)C(OCC)=O)=O
InChi:	InChI=1S/C15H19NO7/c1-2-23-15(22)12(18)8-13(19)16-11(14(20)21)7-9-3-5-10(17)6-4-9/h3-6,11-12,17-18H,2,7-8H2,1H3,(H,16,19)(H,20,21)/t11-,12+/m0/s1
Definition date:	2019-02-07
Last modified:	2024-09-27
Release date:	2019-05-01
Identifier:	N-[(3R)-4-ethoxy-3-hydroxy-4-oxobutanoyl]-L-tyrosine

PH6

PH6
Name:	(4S)-4-cyclohexyl-L-proline
Formula:	C11 H19 N O2
SMILES:	O=C(O)C2NCC(C1CCCCC1)C2
InChi:	InChI=1S/C11H19NO2/c13-11(14)10-6-9(7-12-10)8-4-2-1-3-5-8/h8-10,12H,1-7H2,(H,13,14)/t9-,10+/m1/s1
Definition date:	2015-02-06
Last modified:	2024-09-27
Release date:	2015-06-03
Identifier:	(4S)-4-cyclohexyl-L-proline

BJM

BJM
Name:	(2~{S})-2-azanyl-1-[(1~{S},3~{S},5~{S})-3-(iminomethyl)-2-azabicyclo[3.1.0]hexan-2-yl]-2-[(5~{R},7~{S})-3-oxidanyl-1-ad amantyl]ethanone
Formula:	C18 H27 N3 O2
SMILES:	N[CH](C(=O)N1[CH](C[CH]2C[CH]12)C=N)C34C[CH]5C[CH](CC(O)(C5)C3)C4
InChi:	InChI=1S/C18H27N3O2/c19-8-13-2-12-3-14(12)21(13)16(22)15(20)17-4-10-1-11(5-17)7-18(23,6-10)9-17/h8,10-15,19,23H,1-7,9,20H2/t10-,11+,12-,13+,14+,15-,17+,18-/m1/s1
Synonyms:	Saxagliptin, bound form
Definition date:	2007-12-13
Last modified:	2024-09-27
Identifier:	(2~{S})-2-azanyl-1-[(1~{S},3~{S},5~{S})-3-(iminomethyl)-2-azabicyclo[3.1.0]hexan-2-yl]-2-[(5~{R},7~{S})-3-oxidanyl-1-adamantyl]ethanone

PH8

PH8
Name:	5-phenyl-L-norvaline
Formula:	C11 H15 N O2
SMILES:	C(O)(=O)C(N)CCCc1ccccc1
InChi:	InChI=1S/C11H15NO2/c12-10(11(13)14)8-4-7-9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8,12H2,(H,13,14)/t10-/m0/s1
Definition date:	2015-03-10
Last modified:	2024-09-27
Release date:	2015-04-15
Identifier:	5-phenyl-L-norvaline

BJO

BJO
Name:	(4Z)-4-amino-4-{1-(carboxymethyl)-5-oxo-4-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1,5-dihydro-2H-imidazol-2-ylidene}butanoic acid
Formula:	C16 H15 N3 O6
SMILES:	O=C(CCC(=C2/N=C(C=C1/C=CC(C=C1)=O)C(=O)N2CC(=O)O)N)O
InChi:	InChI=1S/C16H15N3O6/c17-11(5-6-13(21)22)15-18-12(16(25)19(15)8-14(23)24)7-9-1-3-10(20)4-2-9/h1-4,7H,5-6,8,17H2,(H,21,22)(H,23,24)/b15-11-
Synonyms:	CHROMOPHORE (GLU-TYR-GLY)
Definition date:	2019-02-07
Last modified:	2024-09-27
Release date:	2019-03-20
Identifier:	(4Z)-4-amino-4-{1-(carboxymethyl)-5-oxo-4-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1,5-dihydro-2H-imidazol-2-ylidene}butanoic acid

PHA

PHA
Name:	PHENYLALANINAL
Formula:	C9 H11 N O
SMILES:	O=CC(N)Cc1ccccc1
InChi:	InChI=1S/C9H11NO/c10-9(7-11)6-8-4-2-1-3-5-8/h1-5,7,9H,6,10H2/t9-/m0/s1
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	(2S)-2-amino-3-phenylpropanal

BJP

BJP
Name:	(1R)-2-PHENYLACETAMIDO-2-(3-CARBOXYPHENYL)ETHYL BORONIC ACID
Formula:	C17 H18 B N O5
SMILES:	O=C(O)c1cc(ccc1)CC(NC(=O)Cc2ccccc2)B(O)O
InChi:	InChI=1S/C17H18BNO5/c20-16(11-12-5-2-1-3-6-12)19-15(18(23)24)10-13-7-4-8-14(9-13)17(21)22/h1-9,15,23-24H,10-11H2,(H,19,20)(H,21,22)/t15-/m0/s1
Definition date:	2000-04-19
Last modified:	2024-09-27
Identifier:	3-{(2R)-2-(dihydroxyboranyl)-2-[(phenylacetyl)amino]ethyl}benzoic acid

PHB

PHB
Name:	P-HYDROXYBENZOIC ACID
Formula:	C7 H6 O3
SMILES:	O=C(O)c1ccc(O)cc1
InChi:	InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	4-hydroxybenzoic acid

PHD

PHD
Name:	ASPARTYL PHOSPHATE
Formula:	C4 H8 N O7 P
SMILES:	O=C(OP(=O)(O)O)CC(C(=O)O)N
InChi:	InChI=1S/C4H8NO7P/c5-2(4(7)8)1-3(6)12-13(9,10)11/h2H,1,5H2,(H,7,8)(H2,9,10,11)/t2-/m0/s1
Definition date:	1999-10-06
Last modified:	2024-09-27
Identifier:	4-oxo-O-phosphono-L-homoserine

PHE

PHE
Name:	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-/m0/s1
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	L-phenylalanine

BJU

BJU
Name:	N-tetradecanoylglycine
Formula:	C16 H31 N O3
SMILES:	C(CCCC(=O)NCC(O)=O)CCCCCCCCC
InChi:	InChI=1S/C16H31NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-15(18)17-14-16(19)20/h2-14H2,1H3,(H,17,18)(H,19,20)
Definition date:	2019-02-07
Last modified:	2024-09-27
Release date:	2024-03-27
Identifier:	N-tetradecanoylglycine

PHI

PHI
Name:	IODO-PHENYLALANINE
Formula:	C9 H10 I N O2
SMILES:	Ic1ccc(cc1)CC(C(=O)O)N
InChi:	InChI=1S/C9H10INO2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m0/s1
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	4-iodo-L-phenylalanine

PHK

PHK
Name:	(2R,3S)-3-AMINO-1-CHLORO-4-PHENYL-BUTAN-2-OL
Formula:	C10 H14 Cl N O
SMILES:	ClCC(O)C(N)Cc1ccccc1
InChi:	InChI=1S/C10H14ClNO/c11-7-10(13)9(12)6-8-4-2-1-3-5-8/h1-5,9-10,13H,6-7,12H2/t9-,10-/m0/s1
Definition date:	2002-10-01
Last modified:	2024-09-27
Identifier:	(2R,3S)-3-amino-1-chloro-4-phenylbutan-2-ol

PHL

PHL
Name:	L-PHENYLALANINOL
Formula:	C9 H13 N O
SMILES:	OCC(N)Cc1ccccc1
InChi:	InChI=1S/C9H13NO/c10-9(7-11)6-8-4-2-1-3-5-8/h1-5,9,11H,6-7,10H2/t9-/m0/s1
Synonyms:	bound form of Phenylalaninal
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	(2S)-2-amino-3-phenylpropan-1-ol

PHQ

PHQ
Name:	benzyl chlorocarbonate
Formula:	C8 H7 Cl O2
SMILES:	ClC(=O)OCc1ccccc1
InChi:	InChI=1S/C8H7ClO2/c9-8(10)11-6-7-4-2-1-3-5-7/h1-5H,6H2
Definition date:	1999-07-15
Last modified:	2024-09-27
Identifier:	benzyl carbonochloridate

PHT

PHT
Name:	PHTHALIC ACID
Formula:	C8 H6 O4
SMILES:	O=C(O)c1ccccc1C(=O)O
InChi:	InChI=1S/C8H6O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H,9,10)(H,11,12)
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	benzene-1,2-dicarboxylic acid

PHV

PHV
Name:	N-[(benzyloxy)carbonyl]-beta-phenyl-D-phenylalanyl-N-[(1S)-4-methoxy-1-phosphonobutyl]-L-prolinamide
Formula:	C33 H40 N3 O8 P
SMILES:	O=C(NC(CCCOC)P(=O)(O)O)C4N(C(=O)C(NC(=O)OCc1ccccc1)C(c2ccccc2)c3ccccc3)CCC4
InChi:	InChI=1S/C33H40N3O8P/c1-43-22-12-20-28(45(40,41)42)34-31(37)27-19-11-21-36(27)32(38)30(35-33(39)44-23-24-13-5-2-6-14-24)29(25-15-7-3-8-16-25)26-17-9-4-10-18-26/h2-10,13-18,27-30H,11-12,19-23H2,1H3,(H,34,37)(H,35,39)(H2,40,41,42)/t27-,28-,30+/m0/s1
Definition date:	2011-03-21
Last modified:	2024-09-27
Identifier:	N-[(benzyloxy)carbonyl]-beta-phenyl-D-phenylalanyl-N-[(1S)-4-methoxy-1-phosphonobutyl]-L-prolinamide

PHZ

PHZ
Name:	1-PHENYLHYDRAZINE
Formula:	C6 H8 N2
SMILES:	NNc1ccccc1
InChi:	InChI=1S/C6H8N2/c7-8-6-4-2-1-3-5-6/h1-5,8H,7H2
Synonyms:	phenyldiazane
Definition date:	2005-07-29
Last modified:	2024-09-27
Identifier:	phenylhydrazine

BKM

BKM
Name:	(2Z)-2-[(1R)-3-{[(2R,3S,4R,7S,8S,11S,13R,16E)-17-ethyl-4,8-dihydroxy-3,7,11,13-tetramethyl-6,15-dioxononadeca-16,18-dien-2-yl]oxy}-1-hydroxy-3-oxopropyl]-3-methylbut-2-enedioic acid
Formula:	C33 H52 O11
SMILES:	C=[C@H]C(=[C@H]C(CC(CC(C)CCC(C(C)C(CC(O)C(C)C(C)OC(=O)CC(/C(C(O)=O)=C(/C(=O)O)C)O)=O)O)C)=O)CC
InChi:	InChI=1S/C33H52O11/c1-9-24(10-2)15-25(34)14-19(4)13-18(3)11-12-26(35)21(6)28(37)16-27(36)20(5)23(8)44-30(39)17-29(38)31(33(42)43)22(7)32(40)41/h9,15,18-21,23,26-27,29,35-36,38H,1,10-14,16-17H2,2-8H3,(H,40,41)(H,42,43)/b24-15-,31-22-/t18-,19+,20+,21-,23+,26-,27+,29+/m0/s1
Synonyms:	Tautomycetin diacid form
Definition date:	2017-08-10
Last modified:	2024-09-27
Release date:	2017-11-29
Identifier:	(2Z)-2-[(1R)-3-{[(2R,3S,4R,7S,8S,11S,13R,16E)-17-ethyl-4,8-dihydroxy-3,7,11,13-tetramethyl-6,15-dioxononadeca-16,18-dien-2-yl]oxy}-1-hydroxy-3-oxopropyl]-3-methylbut-2-enedioic acid

PIA

PIA
Name:	[(4Z)-2-[(1S)-1-aminoethyl]-4-(4-hydroxybenzylidene)-5-oxo-4,5-dihydro-1H-imidazol-1-yl]acetic acid
Formula:	C14 H15 N3 O4
SMILES:	O=C1C(N=C(N1CC(=O)O)C(N)C)=Cc2ccc(O)cc2
InChi:	InChI=1S/C14H15N3O4/c1-8(15)13-16-11(14(21)17(13)7-12(19)20)6-9-2-4-10(18)5-3-9/h2-6,8,18H,7,15H2,1H3,(H,19,20)/b11-6-/t8-/m0/s1
Definition date:	2001-06-22
Last modified:	2024-09-27
Identifier:	[(4Z)-2-[(1S)-1-aminoethyl]-4-(4-hydroxybenzylidene)-5-oxo-4,5-dihydro-1H-imidazol-1-yl]acetic acid

PI
Name:	HYDROGENPHOSPHATE ION
Formula:	H O4 P
SMILES:	[O-]P([O-])(=O)O
InChi:	InChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)/p-2
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	hydrogen phosphate

BL2

BL2
Name:	N-(tert-butoxycarbonyl)-L-leucine
Formula:	C11 H21 N O4
SMILES:	O=C(OC(C)(C)C)NC(C(=O)O)CC(C)C
InChi:	InChI=1S/C11H21NO4/c1-7(2)6-8(9(13)14)12-10(15)16-11(3,4)5/h7-8H,6H2,1-5H3,(H,12,15)(H,13,14)/t8-/m0/s1
Definition date:	2012-05-31
Last modified:	2024-09-27
Release date:	2013-05-22
Identifier:	N-(tert-butoxycarbonyl)-L-leucine

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