Methylestradiol, 11β-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H26O2
Molecular Weight	286.4085
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC[C@H](O)[C@@]1(C)C[C@H](C)[C@]3([H])C4=CC=C(O)C=C4CC[C@@]23[H]

InChI

InChIKey=DMSFWIJHZMGIJI-ARHYUZGJSA-N

InChI=1S/C19H26O2/c1-11-10-19(2)16(7-8-17(19)21)15-5-3-12-9-13(20)4-6-14(12)18(11)15/h4,6,9,11,15-18,20-21H,3,5,7-8,10H2,1-2H3/t11-,15-,16-,17-,18+,19-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C19H26O2
Molecular Weight	286.4085
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 09:37:24 GMT 2023` Edited by `admin` on `Sat Dec 16 09:37:24 GMT 2023`
Record UNII	52R3HC3JR7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Methylestradiol, 11β-

Common Name

English

Estra-1,3,5(10)-triene-3,17β-diol, 11β-methyl-

Common Name

English

(1S,3aS,3bS,9bS,10S,11aS)-10,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,7-diol

Systematic Name

English

11β-Methylestradiol

Common Name

English

11β-Methyl-estra-1,3,5(10)-triene-3,17β-diol

Common Name

English

(11β,17β)-11-Methylestra-1,3,5(10)-triene-3,17-diol

Common Name

English

Estra-1,3,5(10)-triene-3,17-diol, 11-methyl-, (11β,17β)-

Common Name

English

Code System Code Type Description

FDA UNII

52R3HC3JR7

Created by admin on Sat Dec 16 09:37:24 GMT 2023 , Edited by admin on Sat Dec 16 09:37:24 GMT 2023

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CAS

23637-93-6

Created by admin on Sat Dec 16 09:37:24 GMT 2023 , Edited by admin on Sat Dec 16 09:37:24 GMT 2023

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EPA CompTox

DTXSID60946455

Created by admin on Sat Dec 16 09:37:24 GMT 2023 , Edited by admin on Sat Dec 16 09:37:24 GMT 2023

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PUBCHEM

11890443

Created by admin on Sat Dec 16 09:37:24 GMT 2023 , Edited by admin on Sat Dec 16 09:37:24 GMT 2023

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