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CHEBI:225717 - Antcamphorol K

ChEBI IDCHEBI:225717
ChEBI NameAntcamphorol K
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SubmitterMetaboLights
DownloadsMolfile
FormulaC29H44O3
Net Charge0
Average Mass440.668
Monoisotopic Mass440.32905
SMILESC=C(CC[C@@H](C)[C@H]1CC[C@@]2(O)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)[C@@H](C)[C@@H]1CC3)C(C)C
InChIInChI=1S/C29H44O3/c1-17(2)18(3)8-9-19(4)21-12-15-29(32)23-11-10-22-20(5)24(30)13-14-27(22,6)26(23)25(31)16-28(21,29)7/h17,19-22,32H,3,8-16H2,1-2,4-7H3/t19-,20+,21-,22+,27+,28-,29-/m1/s1
InChIKeyROAOZKUPOZIBKH-TVHFOBTRSA-N
Species of MetaboliteComponentSourceComments
Taiwanofungus camphoratus (ncbitaxon:2696576) - PubMed (31891260)
ChEBI Ontology
Outgoing Relation(s)
Antcamphorol K (CHEBI:225717) is a ergostanoid (CHEBI:50403)
IUPAC Name 
(4S,5S,10S,13R,14S,17R)-14-hydroxy-4,10,13-trimethyl-17-[(2R)-6-methyl-5-methylideneheptan-2-yl]-1,2,4,5,6,7,12,15,16,17-decahydrocyclopenta[a]phenanthrene-3,11-dione