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CHEBI:221547 - Dasyscyphin A

ChEBI IDCHEBI:221547
ChEBI NameDasyscyphin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H36O4
Net Charge0
Average Mass364.526
Monoisotopic Mass364.26136
SMILESC[C@H]1C[C@@H](O)[C@H]2C[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@]3(C)[C@@]2(O)C1=O
InChIInChI=1S/C22H36O4/c1-12-10-14(23)13-11-16-20(4)8-7-17(24)19(2,3)15(20)6-9-21(16,5)22(13,26)18(12)25/h12-17,23-24,26H,6-11H2,1-5H3/t12-,13+,14+,15-,16+,17-,20-,21-,22-/m0/s1
InChIKeyBAEMUVUHSXFRBX-FMVSEYOSSA-N
Species of MetaboliteComponentSourceComments
Dasyscyphus (ncbitaxon:318839) - DOI (10.1016/j.tet.2005.11.041)
ChEBI Ontology
Outgoing Relation(s)
Dasyscyphin A (CHEBI:221547) is a tertiary alcohol (CHEBI:26878)
IUPAC Name 
(3S,4aR,6aS,6bR,8S,10R,10aR,11aR,11bS)-3,6b,10-trihydroxy-4,4,6a,8,11b-pentamethyl-1,2,3,4a,5,6,8,9,10,10a,11,11a-dodecahydrobenzo[a]luoren-7-one
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9676270ChemSpider