NCX-6560

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C37H42FN3O8
Molecular Weight	675.7431
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(=O)OCCCCO[N+]([O-])=O)C3=CC=C(F)C=C3)C4=CC=CC=C4

InChI

InChIKey=QBBIDMMGINYIJJ-FIRIVFDPSA-N

InChI=1S/C37H42FN3O8/c1-25(2)35-34(37(45)39-29-13-7-4-8-14-29)33(26-11-5-3-6-12-26)36(27-15-17-28(38)18-16-27)40(35)20-19-30(42)23-31(43)24-32(44)48-21-9-10-22-49-41(46)47/h3-8,11-18,25,30-31,42-43H,9-10,19-24H2,1-2H3,(H,39,45)/t30-,31-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C37H42FN3O8
Molecular Weight	675.7431
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:41:05 GMT 2023` Edited by `admin` on `Sat Dec 16 08:41:05 GMT 2023`
Record UNII	QR7RH66QDB
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NCX-6560

Code

English

NCX6560

Code

English

1H-PYRROLE-1-HEPTANOIC ACID, 2-(4-FLUOROPHENYL)-.BETA.,.DELTA.-DIHYDROXY-5-(1-METHYLETHYL)-3-PHENYL-4-((PHENYLAMINO)CARBONYL)-, 4-(NITROOXY)BUTYL ESTER, (.BETA.R,.DELTA.R)-

Systematic Name

English

4-(NITROOXY)BUTYL (.BETA.R,.DELTA.R)-2-(4-FLUOROPHENYL)-.BETA.,.DELTA.-DIHYDROXY-5-(1-METHYLETHYL)-3-PHENYL-4-((PHENYLAMINO)CARBONYL)-1H-PYRROLE-1-HEPTANOATE

Systematic Name

English

Code System Code Type Description

FDA UNII

QR7RH66QDB

Created by admin on Sat Dec 16 08:41:06 GMT 2023 , Edited by admin on Sat Dec 16 08:41:06 GMT 2023

PRIMARY

PUBCHEM

11239321

Created by admin on Sat Dec 16 08:41:06 GMT 2023 , Edited by admin on Sat Dec 16 08:41:06 GMT 2023

PRIMARY

CAS

803728-45-2

Created by admin on Sat Dec 16 08:41:06 GMT 2023 , Edited by admin on Sat Dec 16 08:41:06 GMT 2023

PRIMARY

Related Record Type Details


					QR7RH66QDB

NCX-6560

ACTIVE MOIETY