6-Ketoestrone

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H20O3
Molecular Weight	284.3496
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CCC(=O)[C@@]1(C)CC[C@]3([H])C4=CC=C(O)C=C4C(=O)C[C@@]23[H]

InChI

InChIKey=JOVYPIGRPWIXHQ-ONUSSAAZSA-N

InChI=1S/C18H20O3/c1-18-7-6-12-11-3-2-10(19)8-14(11)16(20)9-13(12)15(18)4-5-17(18)21/h2-3,8,12-13,15,19H,4-7,9H2,1H3/t12-,13-,15+,18+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C18H20O3
Molecular Weight	284.3496
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:51:14 GMT 2023` Edited by `admin` on `Sat Dec 16 19:51:14 GMT 2023`
Record UNII	WJN9234S5H
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

6-Ketoestrone

Common Name

English

(8R,9S,13S,14S)-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-6,17-dione

Systematic Name

English

6-Oxoestrone

Common Name

English

6-Keto-estrone

Common Name

English

Estra-1,3,5(10)-triene-6,17-dione, 3-hydroxy-

Common Name

English

3-Hydroxyestra-1,3,5(10)-triene-6,17-dione

Common Name

English

Code System Code Type Description

FDA UNII

WJN9234S5H

Created by admin on Sat Dec 16 19:51:14 GMT 2023 , Edited by admin on Sat Dec 16 19:51:14 GMT 2023

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PUBCHEM

12985714

Created by admin on Sat Dec 16 19:51:14 GMT 2023 , Edited by admin on Sat Dec 16 19:51:14 GMT 2023

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EPA CompTox

DTXSID50514400

Created by admin on Sat Dec 16 19:51:14 GMT 2023 , Edited by admin on Sat Dec 16 19:51:14 GMT 2023

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CAS

1476-34-2

Created by admin on Sat Dec 16 19:51:14 GMT 2023 , Edited by admin on Sat Dec 16 19:51:14 GMT 2023

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