[[[(3E)-20-Oxopregn-4-en-3-ylidene]amino]oxy]acetic acid

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H33NO4
Molecular Weight	387.5124
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of [[[(3E)-20-Oxopregn-4-en-3-ylidene]amino]oxy]acetic acid

Structure Search

SMILES

CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=C\C(CC[C@]4(C)[C@H]3CC[C@]12C)=N\OCC(O)=O

InChI

InChIKey=PPELYUTTZHLIAZ-CDUDAXDSSA-N

InChI=1S/C23H33NO4/c1-14(25)18-6-7-19-17-5-4-15-12-16(24-28-13-21(26)27)8-10-22(15,2)20(17)9-11-23(18,19)3/h12,17-20H,4-11,13H2,1-3H3,(H,26,27)/b24-16+/t17-,18+,19-,20-,22-,23+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C23H33NO4
Molecular Weight	387.5124
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 14:48:34 GMT 2025` Edited by `admin` on `Wed Apr 02 14:48:34 GMT 2025`
Record UNII	8N5C9L9PDH
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

Acetic acid, [[[(3E)-20-oxopregn-4-en-3-ylidene]amino]oxy]-

Preferred Name

English

[[[(3E)-20-Oxopregn-4-en-3-ylidene]amino]oxy]acetic acid

Systematic Name

English

Code System Code Type Description

CAS

58116-42-0

Created by admin on Wed Apr 02 14:48:34 GMT 2025 , Edited by admin on Wed Apr 02 14:48:34 GMT 2025

PRIMARY

PUBCHEM

11977776

Created by admin on Wed Apr 02 14:48:34 GMT 2025 , Edited by admin on Wed Apr 02 14:48:34 GMT 2025

PRIMARY

FDA UNII

8N5C9L9PDH

Created by admin on Wed Apr 02 14:48:34 GMT 2025 , Edited by admin on Wed Apr 02 14:48:34 GMT 2025

PRIMARY