17-(ACETYLOXY)-6-CHLORO-PREGNA-1,4-DIENE-3,20-DIONE, (6.ALPHA.)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H29ClO4
Molecular Weight	404.927
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 17-(ACETYLOXY)-6-CHLORO-PREGNA-1,4-DIENE-3,20-DIONE, (6.ALPHA.)-

Structure Search

SMILES

[H][C@@]12CC[C@](OC(C)=O)(C(C)=O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])C[C@H](Cl)C4=CC(=O)C=C[C@]34C

InChI

InChIKey=AQDNTKZTMCWYDA-WXLIAARGSA-N

InChI=1S/C23H29ClO4/c1-13(25)23(28-14(2)26)10-7-18-16-12-20(24)19-11-15(27)5-8-21(19,3)17(16)6-9-22(18,23)4/h5,8,11,16-18,20H,6-7,9-10,12H2,1-4H3/t16-,17+,18+,20+,21-,22+,23+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C23H29ClO4
Molecular Weight	404.927
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 `Sat Dec 16 08:04:43 GMT 2023` Edited by `admin` on `Sat Dec 16 08:04:43 GMT 2023`
Record UNII	8IVS3A4Y7Z
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

17-(ACETYLOXY)-6-CHLORO-PREGNA-1,4-DIENE-3,20-DIONE, (6.ALPHA.)-

Systematic Name

English

PREGNA-1,4-DIENE-3,20-DIONE, 6.ALPHA.-CHLORO-17-HYDROXY-, ACETATE

Systematic Name

English

PREGNA-1,4-DIENE-3,20-DIONE, 6-ALPHA-CHLORO-17-ALPHA-HYDROXY-, ACETATE (ESTER)

Common Name

English

PREGNA-1,4-DIENE-3,20-DIONE, 17-(ACETYLOXY)-6-CHLORO-, (6.ALPHA.)-

Systematic Name

English

CISMADINONE ACETATE

Systematic Name

English

6.ALPHA.-CHLORO-17-HYDROXYPREGNA-1,4-DIENE-3,20-DIONE ACETATE

Systematic Name

English

Code System Code Type Description

FDA UNII

8IVS3A4Y7Z