CHEBI:68396 - (22E)-24nor-cholesta-1,4,22-trien-3-one

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ChEBI Name (22E)-24nor-cholesta-1,4,22-trien-3-one
ChEBI ID CHEBI:68396
ChEBI ASCII Name (22E)-24nor-cholesta-1,4,22-trien-3-one
Definition A 3-oxo steroid that is (22E)-24nor-cholesta-1,4,22-triene substituted by an oxo group at position 3. It is isolated from the Hainan soft coral Dendronephthya studeri.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C26H38O
Net Charge 0
Average Mass 366.57930
Monoisotopic Mass 366.29227
InChI InChI=1S/C26H38O/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/h6-7,12,14,16-18,21-24H,8-11,13,15H2,1-5H3/b7-6+/t18-,21+,22-,23+,24+,25+,26-/m1/s1
InChIKey JSHASXVESQAJJO-MZXJRKPGSA-N
SMILES CC(C)\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C
Metabolite of Species Details
Dendronephthya studeri (WORMS:289144) Diethylether soluble extract of frozen soft coral See: PubMed
Roles Classification
Biological Role(s): coral metabolite
Any animal metabolite produced during a metabolic reaction in corals (marine invertebrates).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (22E)-24nor-cholesta-1,4,22-trien-3-one (CHEBI:68396) has role coral metabolite (CHEBI:76498)
(22E)-24nor-cholesta-1,4,22-trien-3-one (CHEBI:68396) is a 3-oxo-Δ1,Δ4-steroid (CHEBI:77166)
Registry Number Type Source
21306702 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21192715 PubMed citation Europe PMC
Last Modified
30 January 2014