(E)-26,27-Dinorergosta-4,22-dien-3-one (CHEBI:174921)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	(E)-26,27-Dinorergosta-4,22-dien-3-one

ChEBI ID	CHEBI:174921

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C26H40O

Net Charge

Average Mass

368.605

Monoisotopic Mass

368.30792

InChI

InChI=1S/C26H40O/c1-17(2)6-7-18(3)22-10-11-23-21-9-8-19-16-20(27)12-14-25(19,4)24(21)13-15-26(22,23)5/h6-7,16-18,21-24H,8-15H2,1-5H3/b7-6+

InChIKey

FFRFYWBYDZTBDQ-VOTSOKGWSA-N

SMILES

O=C1CCC2(C3C(C4C(C(CC4)C(C)/C=C/C(C)C)(CC3)C)CCC2=C1)C

Roles Classification
Biological Role(s):	hormone Originally referring to an endogenous compound that is formed in specialized organ or group of cells and carried to another organ or group of cells, in the same organism, upon which it has a specific regulatory function, the term is now commonly used to include non-endogenous, semi-synthetic and fully synthetic analogues of such compounds. (via steroid hormone )

ChEBI Ontology
Outgoing	(E)-26,27-Dinorergosta-4,22-dien-3-one (CHEBI:174921) is a corticosteroid hormone (CHEBI:36699)

IUPAC Name

10,13-dimethyl-17-[(E)-5-methylhex-3-en-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one