(17.BETA.)-6,17-DIHYDROXY-6-(HYDROXYMETHYL)ANDROSTA-1,4-DIEN-3-ONE

Details

Stereochemistry	EPIMERIC
Molecular Formula	C20H28O4
Molecular Weight	332.4339
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (17.BETA.)-6,17-DIHYDROXY-6-(HYDROXYMETHYL)ANDROSTA-1,4-DIEN-3-ONE

Structure Search

SMILES

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

InChI

InChIKey=DEJCFWQGQLQXMQ-POJIJWSDSA-N

InChI=1S/C20H28O4/c1-18-7-5-12(22)9-16(18)20(24,11-21)10-13-14-3-4-17(23)19(14,2)8-6-15(13)18/h5,7,9,13-15,17,21,23-24H,3-4,6,8,10-11H2,1-2H3/t13-,14-,15-,17-,18+,19-,20?/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H28O4
Molecular Weight	332.4339
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	6 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:37:20 GMT 2023` Edited by `admin` on `Sat Dec 16 16:37:20 GMT 2023`
Record UNII	E683SM8MUX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(17.BETA.)-6,17-DIHYDROXY-6-(HYDROXYMETHYL)ANDROSTA-1,4-DIEN-3-ONE

Systematic Name

English

ANDROSTA-1,4-DIEN-3-ONE, 6,17-DIHYDROXY-6-(HYDROXYMETHYL)-, (17.BETA.)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

101548663

Created by admin on Sat Dec 16 16:37:20 GMT 2023 , Edited by admin on Sat Dec 16 16:37:20 GMT 2023

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CAS

1331732-07-0

Created by admin on Sat Dec 16 16:37:20 GMT 2023 , Edited by admin on Sat Dec 16 16:37:20 GMT 2023

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FDA UNII

E683SM8MUX

Created by admin on Sat Dec 16 16:37:20 GMT 2023 , Edited by admin on Sat Dec 16 16:37:20 GMT 2023

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