ANDROSTENEDIOL 17-BENZOATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H34O3
Molecular Weight	394.5464
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC[C@H](OC(=O)C3=CC=CC=C3)[C@@]1(C)CC[C@@]4([H])[C@@]2([H])CC=C5C[C@@H](O)CC[C@]45C

InChI

InChIKey=BGSWILYBWIQYKQ-DRKCKIEBSA-N

InChI=1S/C26H34O3/c1-25-14-12-19(27)16-18(25)8-9-20-21-10-11-23(26(21,2)15-13-22(20)25)29-24(28)17-6-4-3-5-7-17/h3-8,19-23,27H,9-16H2,1-2H3/t19-,20-,21-,22-,23-,25-,26-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C26H34O3
Molecular Weight	394.5464
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 09:06:05 GMT 2023` Edited by `admin` on `Sat Dec 16 09:06:05 GMT 2023`
Record UNII	26P2GC37AB
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ANDROSTENEDIOL 17-BENZOATE

Common Name

English

ANDROST-5-ENE-3,17-DIOL, 17-BENZOATE, (3.BETA.,17.BETA.)-

Systematic Name

English

NSC-226156

Code

English

ANDROSTENEDIOL 17-BENZOATE [MI]

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID70922442