3-(3-((2Z)-2-(1-(4-((2-(((4R)-4-AMINO-5-HYDROXY-5-OXO-PENTANOYL)AMINO)-3-(CARBOXYMETHYLAMINO)-3-OXO-PROPYL)SULFANYLMETHYL)-3-METHYL-PHENYL)-3-METHYL-5-OXO-PYRAZOL-4-YLIDENE)HYDRAZINO)-2-HYDROXY-PHENYL)BENZOIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C35H37N7O10S
Molecular Weight	747.774
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 3-(3-((2Z)-2-(1-(4-((2-(((4R)-4-AMINO-5-HYDROXY-5-OXO-PENTANOYL)AMINO)-3-(CARBOXYMETHYLAMINO)-3-OXO-PROPYL)SULFANYLMETHYL)-3-METHYL-PHENYL)-3-METHYL-5-OXO-PYRAZOL-4-YLIDENE)HYDRAZINO)-2-HYDROXY-PHENYL)BENZOIC ACID

Structure Search

SMILES

CC1=NN(C(=O)\C1=N/NC2=C(O)C(=CC=C2)C3=CC(=CC=C3)C(O)=O)C4=CC=C(CSC[C@@H](NC(=O)CC[C@@H](N)C(O)=O)C(=O)NCC(O)=O)C(C)=C4

InChI

InChIKey=DMFMVMLGDZHFRA-OBFJLNMCSA-N

InChI=1S/C35H37N7O10S/c1-18-13-23(10-9-22(18)16-53-17-27(32(47)37-15-29(44)45)38-28(43)12-11-25(36)35(51)52)42-33(48)30(19(2)41-42)40-39-26-8-4-7-24(31(26)46)20-5-3-6-21(14-20)34(49)50/h3-10,13-14,25,27,39,46H,11-12,15-17,36H2,1-2H3,(H,37,47)(H,38,43)(H,44,45)(H,49,50)(H,51,52)/b40-30-/t25-,27-/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

3-(3-((2Z)-2-(1-(4-((2-(((4R)-4-AMINO-5-HYDROXY-5-OXO-PENTANOYL)AMINO)-3-(CARBOXYMETHYLAMINO)-3-OXO-PROPYL)SULFANYLMETHYL)-3-METHYL-PHENYL)-3-METHYL-5-OXO-PYRAZOL-4-YLIDENE)HYDRAZINO)-2-HYDROXY-PHENYL)BENZOIC ACID

Systematic Name

English

ELTROMBOPAG METABOLITE M5

Common Name

English

GLUTATHIONE CONJUGATION METABOLITE OF ELTROMBOPAG

Common Name

English

Code System Code Type Description

FDA UNII

ZT5EZ569F9

Created by admin on Sat Dec 16 15:13:11 GMT 2023 , Edited by admin on Sat Dec 16 15:13:11 GMT 2023