16.ALPHA.-HYDROXYESTRONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H22O3
Molecular Weight	286.3655
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=WPOCIZJTELRQMF-QFXBJFAPSA-N

InChI=1S/C18H22O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-16,19-20H,2,4,6-7,9H2,1H3/t13-,14-,15+,16-,18+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C18H22O3
Molecular Weight	286.3655
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:20:09 UTC 2023` Edited by `admin` on `Sat Dec 16 08:20:09 UTC 2023`
Record UNII	JY611949JU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

16.ALPHA.-HYDROXYESTRONE

Common Name

English

(16R)-3,16.ALPHA.-DIHYDROXY-1,3,5(10)-ESTRATRIEN-17-ONE

Systematic Name

English

Hydroxyestrone [WHO-DD]

Common Name

English

C05300

Code

English

16.ALPHA.-OHE1

Common Name

English

(8R,9S,13S,14S,16R)-3,16-DIHYDROXY-13-METHYL-7,8,9,11,12,14,15,16-OCTAHYDRO-6H-CYCLOPENTA(A)PHENANTHREN-17-ONE

Systematic Name

English

J130.683I

Code

English

3,16.ALPHA.-DIHYDROXY-1,3,5(10)-ESTRATRIEN-17-ONE

Systematic Name

English

ESTRA-1,3,5(10)-TRIENE-3,16.ALPHA.-DIOL-17-ONE

Systematic Name

English

16ALPHA-HYDROXYESTRONE

Common Name

English

ESTRA-1,3,5(10)-TRIEN-17-ONE, 3,16-DIHYDROXY-, (16.ALPHA.)-

Systematic Name

English

(16.ALPHA.)-3,16-DIHYDROXYESTRA-1(10),2,4-TRIEN-17-ONE

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C2181