16-DEHYDROPREGNENOLONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H30O2
Molecular Weight	314.4617
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC=C(C(C)=O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CC=C4C[C@@H](O)CC[C@]34C

InChI

InChIKey=YLFRRPUBVUAHSR-RRPFGEQOSA-N

InChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,6,15-16,18-19,23H,5,7-12H2,1-3H3/t15-,16-,18-,19-,20-,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H30O2
Molecular Weight	314.4617
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
regulation of cell cycle arrest 1 Target ID: GO:0071156 Sources: https://www.ncbi.nlm.nih.gov/pubmed/22694166	Modulator 828

PubMed

Title	Date	PubMed
Cytotoxic constituents from Solanum lyratum.	2006 Feb	16526277
In vivo and in vitro effect of novel 4,16-pregnadiene-6,20-dione derivatives, as 5alpha-reductase inhibitors.	2008 Sep	18644453

Substance Class	Chemical Created by `admin` on `Sat Dec 16 05:49:20 GMT 2023` Edited by `admin` on `Sat Dec 16 05:49:20 GMT 2023`
Record UNII	7349506P5S
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

16-DEHYDROPREGNENOLONE

Common Name

English

(-)-PREGNADIENOLONE

Common Name

English

PREGNADIENOLONE

Common Name

English

3.BETA.-HYDROXY-20-OXOPREGNA-5,16-DIENE

Systematic Name

English

3.BETA.-HYDROXY-.DELTA.5,16-PREGNADIEN-20-ONE

Common Name

English

NSC-15467

Code

English

PREGNA-5,16-DIEN-20-ONE, 3.BETA.-HYDROXY-

Systematic Name

English

.DELTA.16-PREGNENOLONE

Common Name

English

16-DEHYDROPREGNOLONE

Common Name

English

PREGNA-5,16-DIEN-20-ONE, 3-HYDROXY-, (3.BETA.)-

Systematic Name

English

3.BETA.-HYDROXYPREGNA-5,16-DIEN-20-ONE

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

214-602-8