Norverapamil N-β-D-Glucuronide

Details

Stereochemistry	EPIMERIC
Molecular Formula	C32H44N2O10
Molecular Weight	616.6992
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Norverapamil N-β-D-Glucuronide

Structure Search

SMILES

COC1=C(OC)C=C(CCN(CCCC(C#N)(C(C)C)C2=CC(OC)=C(OC)C=C2)[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)C=C1

InChI

InChIKey=PMBMAYXZKGXGNE-OOIBDUHFSA-N

InChI=1S/C32H44N2O10/c1-19(2)32(18-33,21-9-11-23(41-4)25(17-21)43-6)13-7-14-34(15-12-20-8-10-22(40-3)24(16-20)42-5)30-28(37)26(35)27(36)29(44-30)31(38)39/h8-11,16-17,19,26-30,35-37H,7,12-15H2,1-6H3,(H,38,39)/t26-,27-,28+,29-,30+,32?/m0/s1

HIDE SMILES / InChI

Molecular Formula	C32H44N2O10
Molecular Weight	616.6992
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	5 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:52:09 GMT 2023` Edited by `admin` on `Sat Dec 16 19:52:09 GMT 2023`
Record UNII	KZ23L8U26J
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

Norverapamil N-β-D-Glucuronide

Common Name

English

1-[[4-Cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl][2-(3,4-dimethoxyphenyl)ethyl]amino]-1-deoxy-β-D-glucopyranuronic acid

Systematic Name

English

β-D-Glucopyranuronic acid, 1-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl][2-(3,4-dimethoxyphenyl)ethyl]amino]-1-deoxy-

Systematic Name

English

6-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl]-[2-(3,4-dimethoxyphenyl)ethyl]amino]-3,4,5-trihydroxyoxane-2-carboxylic acid

Systematic Name

English

Code System Code Type Description

CAS

126883-99-6

Created by admin on Sat Dec 16 19:52:09 GMT 2023 , Edited by admin on Sat Dec 16 19:52:09 GMT 2023

PRIMARY

FDA UNII

KZ23L8U26J

Created by admin on Sat Dec 16 19:52:09 GMT 2023 , Edited by admin on Sat Dec 16 19:52:09 GMT 2023

PRIMARY

PUBCHEM

71751261

Created by admin on Sat Dec 16 19:52:09 GMT 2023 , Edited by admin on Sat Dec 16 19:52:09 GMT 2023

PRIMARY