6.BETA.-HYDROXY-ETHINYLESTRADIOL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H24O3
Molecular Weight	312.4028
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 6.BETA.-HYDROXY-ETHINYLESTRADIOL

Structure Search

SMILES

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

InChI

InChIKey=XFBUZQAUNLRYCT-ZPNQOMQUSA-N

InChI=1S/C20H24O3/c1-3-20(23)9-7-17-15-11-18(22)16-10-12(21)4-5-13(16)14(15)6-8-19(17,20)2/h1,4-5,10,14-15,17-18,21-23H,6-9,11H2,2H3/t14-,15-,17+,18-,19+,20+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C20H24O3
Molecular Weight	312.4028
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 01:03:20 UTC 2023` Edited by `admin` on `Sat Dec 16 01:03:20 UTC 2023`
Record UNII	G1W6D0O0CW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

6.BETA.-HYDROXY-ETHINYLESTRADIOL

Common Name

English

ETHINYLESTRADIOL IMPURITY F [EP IMPURITY]

Common Name

English

19-NOR-17.ALPHA.-PREGNA-1,3,5(10)-TRIEN-20-YNE-3,6.BETA.,17-TRIOL

Common Name

English

19-NORPREGNA-1,3,5(10)-TRIEN-20-YNE-3,6,17-TRIOL, (6.BETA.,17.ALPHA.)-

Common Name

English

6.BETA.-HYDROXY-ETHINYL ESTRADIOL

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID80204867