4-HYDROXYESTRADIOL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H24O3
Molecular Weight	288.3814
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=QOZFCKXEVSGWGS-ZHIYBZGJSA-N

InChI=1S/C18H24O3/c1-18-9-8-11-10-4-6-15(19)17(21)13(10)3-2-12(11)14(18)5-7-16(18)20/h4,6,11-12,14,16,19-21H,2-3,5,7-9H2,1H3/t11-,12-,14+,16+,18+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C18H24O3
Molecular Weight	288.3814
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 `Fri Dec 15 15:19:05 UTC 2023` Edited by `admin` on `Fri Dec 15 15:19:05 UTC 2023`
Record UNII	C3ZO03450E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-HYDROXYESTRADIOL

Common Name

English

1,3,5(10)-ESTRATRIENE-3,4,17.BETA.-TRIOL

Systematic Name

English

ESTRADIOL METABOLITE (4-HYDROXYESTRADIOL)

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C347