20-(Acetyloxy)-3-oxopregna-1,4,9(11),17(20)-tetraen-21-al

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H26O4
Molecular Weight	366.4501
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 20-(Acetyloxy)-3-oxopregna-1,4,9(11),17(20)-tetraen-21-al

Structure Search

SMILES

CC(=O)O\C(C=O)=C1\CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]12C

InChI

InChIKey=LAQXECSDNWRMRT-IHPNUJGJSA-N

InChI=1S/C23H26O4/c1-14(25)27-21(13-24)20-7-6-18-17-5-4-15-12-16(26)8-10-22(15,2)19(17)9-11-23(18,20)3/h8-10,12-13,17-18H,4-7,11H2,1-3H3/b21-20-/t17-,18-,22-,23-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C23H26O4
Molecular Weight	366.4501
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 20:59:41 GMT 2025` Edited by `admin` on `Wed Apr 02 20:59:41 GMT 2025`
Record UNII	82GYN7D7RT
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

20-Acetoxy-3-oxopregna-1,4,9(11),17(20)-tetraen-21-al

Preferred Name

English

20-(Acetyloxy)-3-oxopregna-1,4,9(11),17(20)-tetraen-21-al

Systematic Name

English

[1-[(8S,10S,13S,14S)-10,13-Dimethyl-3-oxo-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-ylidene]-2-oxoethyl] acetate

Systematic Name

English

Pregna-1,4,9(11),17(20)-tetraen-21-al, 20-(acetyloxy)-3-oxo-

Systematic Name

English

Code System Code Type Description

PUBCHEM

57039071

Created by admin on Wed Apr 02 20:59:41 GMT 2025 , Edited by admin on Wed Apr 02 20:59:41 GMT 2025

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FDA UNII

82GYN7D7RT

Created by admin on Wed Apr 02 20:59:41 GMT 2025 , Edited by admin on Wed Apr 02 20:59:41 GMT 2025

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CAS

50557-66-9

Created by admin on Wed Apr 02 20:59:41 GMT 2025 , Edited by admin on Wed Apr 02 20:59:41 GMT 2025

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