ESTRADIOL HEXAHYDROBENZOATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H34O3
Molecular Weight	382.5357
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ESTRADIOL HEXAHYDROBENZOATE

Structure Search

SMILES

[H][C@@]12CC[C@H](OC(=O)C3CCCCC3)[C@@]1(C)CC[C@]4([H])C5=CC=C(O)C=C5CC[C@@]24[H]

InChI

InChIKey=IVRCALGRJCHPRV-BZDYCCQFSA-N

InChI=1S/C25H34O3/c1-25-14-13-20-19-10-8-18(26)15-17(19)7-9-21(20)22(25)11-12-23(25)28-24(27)16-5-3-2-4-6-16/h8,10,15-16,20-23,26H,2-7,9,11-14H2,1H3/t20-,21-,22+,23+,25+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C25H34O3
Molecular Weight	382.5357
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 08:31:40 UTC 2023` Edited by `admin` on `Sat Dec 16 08:31:40 UTC 2023`
Record UNII	DI3496530P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ESTRADIOL HEXAHYDROBENZOATE

Common Name

English

ESTRA-1,3,5(10)-TRIENE-3,17-DIOL (17.BETA.)-, 17-CYCLOHEXANECARBOXYLATE

Systematic Name

English

CYCLOHEXANECARBOXYLIC ACID, 17-ESTER WITH ESTRADIOL

Common Name

English

ESTRADIOL, 17-CYCLOHEXANECARBOXYLATE

Systematic Name

English

Estradiol Hexahydrobenzoate [WHO-DD]

Common Name

English

Code System Code Type Description

EVMPD

SUB35579