ISOTIBOLONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H28O2
Molecular Weight	312.4458
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC[C@@](O)(C#C)[C@@]1(C)CC[C@]3([H])[C@@]4([H])CCC(=O)C=C4C[C@@H](C)[C@@]23[H]

InChI

InChIKey=WAOKMNBZWBGYIK-KIURNNQRSA-N

InChI=1S/C21H28O2/c1-4-21(23)10-8-18-19-13(2)11-14-12-15(22)5-6-16(14)17(19)7-9-20(18,21)3/h1,12-13,16-19,23H,5-11H2,2-3H3/t13-,16+,17-,18+,19-,20+,21+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C21H28O2
Molecular Weight	312.4458
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:39:02 GMT 2023` Edited by `admin` on `Sat Dec 16 15:39:02 GMT 2023`
Record UNII	LHZ8R2OW0M
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISOTIBOLONE

Common Name

English

7.ALPHA.-METHYLNORETHINDRONE

Common Name

English

(7.ALPHA.,17.ALPHA.)-17-HYDROXY-7-METHYL-19-NORPREGN-4-EN-20-YN-3-ONE

Systematic Name

English

ORG-OM-38

Code

English

NSC-142228

Code

English

19-NORPREGN-4-EN-20-YN-3-ONE, 17-HYDROXY-7-METHYL-, (7.ALPHA.,17.ALPHA.)-

Systematic Name

English

.DELTA.4-TIBOLONE

Common Name

English

7.ALPHA.-METHYL-17.ALPHA.-ETHYNYL-19-NORTESTOSTERONE

Common Name

English

7.ALPHA.-METHYLNORETHISTERONE

Common Name

English

Code System Code Type Description

PUBCHEM

22814761