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CHEBI:203059 - Radianspene M

ChEBI IDCHEBI:203059
ChEBI NameRadianspene M
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SubmitterMetaboLights
DownloadsMolfile
FormulaC40H50O6
Net Charge0
Average Mass626.834
Monoisotopic Mass626.36074
SMILESCC(C)C1=C(O)C(=O)C2=CC3=C(CCC4=C5C=C6C(=O)C(O)=C(C(C)C)[C@@]6(C)CC[C@]5(C)CCC4=O)C(=O)CC[C@@]3(C)CC[C@@]21C
InChIInChI=1S/C40H50O6/c1-21(2)31-35(45)33(43)27-19-25-23(29(41)11-13-37(25,5)15-17-39(27,31)7)9-10-24-26-20-28-34(44)36(46)32(22(3)4)40(28,8)18-16-38(26,6)14-12-30(24)42/h19-22,45-46H,9-18H2,1-8H3/t37-,38-,39-,40-/m0/s1
InChIKeyRBXXKGHOPCEZHW-YKKXUYLKSA-N
Species of MetaboliteComponentSourceComments
Coprinus (ncbitaxon:5345) - PubMed (22521133)
ChEBI Ontology
Outgoing Relation(s)
Radianspene M (CHEBI:203059) is a sesquarterpenoid (CHEBI:51961)
IUPAC Name 
(3aR,5aR)-9-[2-[(3aR,5aR)-2-hydroxy-3a,5a-dimethyl-1,8-dioxo-3-propan-2-yl-4,5,6,7-tetrahydrobenzo[]azulen-9-yl]ethyl]-2-hydroxy-3a,5a-dimethyl-3-propan-2-yl-4,5,6,7-tetrahydrobenzo[g]azulene-1,8-dione
Manual XrefsDatabases
78442298ChemSpider