Dihydroxy-16-propylestr-4-en-3-one 17-acetate, 16-beta,17-beta-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H34O4
Molecular Weight	374.5137
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Dihydroxy-16-propylestr-4-en-3-one 17-acetate, 16-beta,17-beta-

Structure Search

SMILES

[H][C@@]12C[C@@](O)(CCC)[C@H](OC(C)=O)[C@@]1(C)CC[C@]3([H])[C@@]4([H])CCC(=O)C=C4CC[C@@]23[H]

InChI

InChIKey=BRYMKVQCTXDUJO-GXYAOEHPSA-N

InChI=1S/C23H34O4/c1-4-10-23(26)13-20-19-7-5-15-12-16(25)6-8-17(15)18(19)9-11-22(20,3)21(23)27-14(2)24/h12,17-21,26H,4-11,13H2,1-3H3/t17-,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	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:30:33 GMT 2023` Edited by `admin` on `Sat Dec 16 08:30:33 GMT 2023`
Record UNII	9G9EFZ3DHN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Dihydroxy-16-propylestr-4-en-3-one 17-acetate, 16-beta,17-beta-

Common Name

English

Estr-4-en-3-one, 16β,17β-dihydroxy-16-propyl-, 17-acetate

Common Name

English

[(8R,9S,10R,13S,14S,16S,17R)-16-hydroxy-13-methyl-3-oxo-16-propyl-1,2,6,7,8,9,10,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-17-yl] acetate

Systematic Name

English

[(16S,17R)-16-Hydroxy-13-methyl-3-oxo-16-propyl-1,2,6,7,8,9,10,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-17-yl]acetate

Systematic Name

English

Code System Code Type Description

CAS

97831-31-7

Created by admin on Sat Dec 16 08:30:33 GMT 2023 , Edited by admin on Sat Dec 16 08:30:33 GMT 2023

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FDA UNII

9G9EFZ3DHN

Created by admin on Sat Dec 16 08:30:33 GMT 2023 , Edited by admin on Sat Dec 16 08:30:33 GMT 2023

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EPA CompTox

DTXSID70913633

Created by admin on Sat Dec 16 08:30:33 GMT 2023 , Edited by admin on Sat Dec 16 08:30:33 GMT 2023

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PUBCHEM

23623225

Created by admin on Sat Dec 16 08:30:33 GMT 2023 , Edited by admin on Sat Dec 16 08:30:33 GMT 2023

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