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

C[C@@H]1CC2=CC(=O)CC[C@@H]2[C@H]3CC[C@@]4(C)[C@@H](CC[C@@]4(O)C#C)[C@H]13

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 `Wed Apr 02 06:13:39 GMT 2025` Edited by `admin` on `Wed Apr 02 06:13:39 GMT 2025`
Record UNII	LHZ8R2OW0M
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-142228

Preferred Name

English

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

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