ESTRONE METHYL ETHER, (±)-

Details

Stereochemistry	RACEMIC
Molecular Formula	C19H24O2
Molecular Weight	284.3927
Optical Activity	( + / - )
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=BCWWDWHFBMPLFQ-VXNCWWDNSA-N

InChI=1S/C19H24O2/c1-19-10-9-15-14-6-4-13(21-2)11-12(14)3-5-16(15)17(19)7-8-18(19)20/h4,6,11,15-17H,3,5,7-10H2,1-2H3/t15-,16-,17+,19+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C19H24O2
Molecular Weight	284.3927
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

PubMed

Title	Date	PubMed
Elucidation of the dissociation pathways of electro-ionized estrone.	2010 Apr 15	20209664
Elucidation of the decomposition pathways of protonated and deprotonated estrone ions: application to the identification of photolysis products.	2010 Oct 30	20872633

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:33:15 GMT 2023` Edited by `admin` on `Sat Dec 16 08:33:15 GMT 2023`
Record UNII	59359RSB8X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ESTRONE METHYL ETHER, (±)-

Common Name

English

ESTRA-1,3,5(10)-TRIEN-17-ONE, 3-(METHOXY)-, (±)-

Systematic Name

English

(±)-O-METHYLESTRONE

Common Name

English

ESTRONE METHYL ETHER, DL-

Common Name

English

ESTRONE METHYL ETHER DL-FORM [MI]

Common Name

English

DL-ESTRONE METHYL ETHER

Common Name

English

Code System Code Type Description

PUBCHEM

92895

Created by admin on Sat Dec 16 08:33:15 GMT 2023 , Edited by admin on Sat Dec 16 08:33:15 GMT 2023

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CAS

1091-94-7

Created by admin on Sat Dec 16 08:33:15 GMT 2023 , Edited by admin on Sat Dec 16 08:33:15 GMT 2023

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FDA UNII

59359RSB8X

Created by admin on Sat Dec 16 08:33:15 GMT 2023 , Edited by admin on Sat Dec 16 08:33:15 GMT 2023

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