(1?)-17-(Acetyloxy)-6-chloro-1-(chloromethyl)pregna-4,6-diene-3,20-dione

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H30Cl2O4
Molecular Weight	453.399
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (1?)-17-(Acetyloxy)-6-chloro-1-(chloromethyl)pregna-4,6-diene-3,20-dione

Structure Search

SMILES

CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=C(Cl)C4=CC(=O)C[C@H](CCl)[C@]4(C)[C@H]3CC[C@]12C)C(C)=O

InChI

InChIKey=MFEGXCLQSLHLPH-HAJWRMEISA-N

InChI=1S/C24H30Cl2O4/c1-13(27)24(30-14(2)28)8-6-18-17-11-21(26)20-10-16(29)9-15(12-25)23(20,4)19(17)5-7-22(18,24)3/h10-11,15,17-19H,5-9,12H2,1-4H3/t15-,17+,18+,19+,22+,23-,24+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H30Cl2O4
Molecular Weight	453.399
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:30:10 GMT 2025` Edited by `admin` on `Wed Apr 02 17:30:10 GMT 2025`
Record UNII	AWV9NYF5CR
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(1?)-17-(Acetyloxy)-6-chloro-1-(chloromethyl)pregna-4,6-diene-3,20-dione

Systematic Name

English

CYPROTERONE ACETATE IMPURITY C [EP IMPURITY]

Preferred Name

English

Pregna-4,6-diene-3,20-dione, 17-(acetyloxy)-6-chloro-1-(chloromethyl)-, (1?)-

Systematic Name

English

6-chloro-1?-(chloromethyl)-3,20-dioxopregna-4,6-dien-17-yl acetate

Systematic Name

English

17-Acetyloxy-6-chloro-1?-chloromethylpregna-4,6-diene-3,20-dione

Systematic Name

English

Code System Code Type Description

CAS

17183-98-1