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

Structure Search

SMILES

[H][C@@]12CC[C@H](C(C)=O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CCC4=C\C(CC[C@]34C)=N/OCC(O)=O

InChI

InChIKey=PPELYUTTZHLIAZ-HZZOJEDPSA-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

Targets

Primary Target	Pharmacology	Condition	Potency
Progesterone receptor 61 Target ID: CHEMBL208 Sources: https://www.ncbi.nlm.nih.gov/pubmed/1833399	Binding Agent 1064

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:16:20 GMT 2023` Edited by `admin` on `Sat Dec 16 19:16:20 GMT 2023`
Record UNII	KS2K5D98A7
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

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

Systematic Name

English

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

Systematic Name

English

Progesterone 3-(o-carboxymethyl)oxime

Systematic Name

English

Code System Code Type Description

FDA UNII

KS2K5D98A7

Created by admin on Sat Dec 16 19:16:20 GMT 2023 , Edited by admin on Sat Dec 16 19:16:20 GMT 2023

PRIMARY

CAS

58116-38-4

Created by admin on Sat Dec 16 19:16:20 GMT 2023 , Edited by admin on Sat Dec 16 19:16:20 GMT 2023

PRIMARY

PUBCHEM

13986221

Created by admin on Sat Dec 16 19:16:20 GMT 2023 , Edited by admin on Sat Dec 16 19:16:20 GMT 2023

PRIMARY