3ALPHA, 5ALPHA-TETRAHYDROSEGESTERONE ACETATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H34O4
Molecular Weight	374.5137
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3ALPHA, 5ALPHA-TETRAHYDROSEGESTERONE ACETATE

Structure Search

SMILES

[H][C@@]12CC(=C)[C@](OC(C)=O)(C(C)=O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CC[C@@]4([H])C[C@H](O)CC[C@]34[H]

InChI

InChIKey=IPAZNHSEEFSYSF-SBOLZLDZSA-N

InChI=1S/C23H34O4/c1-13-11-21-20-7-5-16-12-17(26)6-8-18(16)19(20)9-10-22(21,4)23(13,14(2)24)27-15(3)25/h16-21,26H,1,5-12H2,2-4H3/t16-,17+,18-,19+,20+,21-,22-,23-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C23H34O4
Molecular Weight	374.5137
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 14:41:50 GMT 2023` Edited by `admin` on `Sat Dec 16 14:41:50 GMT 2023`
Record UNII	VL99V496ZB
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3ALPHA, 5ALPHA-TETRAHYDROSEGESTERONE ACETATE

Common Name

English

3.ALPHA., 5.ALPHA.-TETRAHYDROSEGESTERONE ACETATE

Common Name

English

SEGESTERONE ACETATE METABOLITE (3.ALPHA., 5.ALPHA.-TETRAHYDROSEGESTERONE ACETATE)

Common Name

English

3.ALPHA., 5.ALPHA.-THNES

Common Name

English

(1R,3AS,3BR,5AS,7R,9AS,9BR,11AS)-1-ACETYL-7-HYDROXY-11A-METHYL-2-METHYLIDENE-HEXADECAHYDRO-1H-CYCLOPENTA(A)PHENANTHREN-1-YL ACETATE

Systematic Name

English

Code System Code Type Description

FDA UNII

VL99V496ZB

Created by admin on Sat Dec 16 14:41:50 GMT 2023 , Edited by admin on Sat Dec 16 14:41:50 GMT 2023

PRIMARY

PUBCHEM

155804683

Created by admin on Sat Dec 16 14:41:50 GMT 2023 , Edited by admin on Sat Dec 16 14:41:50 GMT 2023

PRIMARY

PUBCHEM

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SEGESTERONE ACETATE

PARENT -> METABOLITE INACTIVE