ETHINYL ESTRADIOL 2-OXY DIMER

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C40H46O4
Molecular Weight	590.7908
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ETHINYL ESTRADIOL 2-OXY DIMER

Structure Search

SMILES

[H][C@@]12CC[C@@](O)(C#C)[C@@]1(C)CC[C@]3([H])C4=CC=C(OC5=C(O)C=C6CC[C@@]7([H])[C@]8([H])CC[C@@](O)(C#C)[C@@]8(C)CC[C@]7([H])C6=C5)C=C4CC[C@@]23[H]

InChI

InChIKey=OJHCQRNXDQVSBN-GGYOKZPMSA-N

InChI=1S/C40H46O4/c1-5-39(42)19-15-33-30-10-7-24-21-26(9-12-27(24)28(30)13-17-37(33,39)3)44-36-23-32-25(22-35(36)41)8-11-31-29(32)14-18-38(4)34(31)16-20-40(38,43)6-2/h1-2,9,12,21-23,28-31,33-34,41-43H,7-8,10-11,13-20H2,3-4H3/t28-,29+,30-,31-,33+,34+,37+,38+,39+,40+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C40H46O4
Molecular Weight	590.7908
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 10
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:55:17 GMT 2023` Edited by `admin` on `Sat Dec 16 18:55:17 GMT 2023`
Record UNII	FYP4J2QBD5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ETHINYL ESTRADIOL 2-OXY DIMER

Common Name

English

19-NORPREGNA-1,3,5(10)-TRIEN-20-YNE-3,17-DIOL, 2-(((17.ALPHA.)-17-HYDROXY-19-NORPREGNA-1,3,5(10)-TRIEN-20-YN-3-YL)OXY)-, (17.ALPHA.)-

Systematic Name

English

Code System Code Type Description

FDA UNII

FYP4J2QBD5

Created by admin on Sat Dec 16 18:55:17 GMT 2023 , Edited by admin on Sat Dec 16 18:55:17 GMT 2023

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CAS

303014-91-7

Created by admin on Sat Dec 16 18:55:17 GMT 2023 , Edited by admin on Sat Dec 16 18:55:17 GMT 2023

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PUBCHEM

101064273

Created by admin on Sat Dec 16 18:55:17 GMT 2023 , Edited by admin on Sat Dec 16 18:55:17 GMT 2023

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