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CHEBI:224258 - Radianspene D

ChEBI IDCHEBI:224258
ChEBI NameRadianspene D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H32O4
Net Charge0
Average Mass336.472
Monoisotopic Mass336.23006
SMILESCC(CO)[C@H]1[C@@H](O)[C@@H](O)C2=CC3=C(CO)CCC[C@@]3(C)CC[C@@]21C
InChIInChI=1S/C20H32O4/c1-12(10-21)16-18(24)17(23)15-9-14-13(11-22)5-4-6-19(14,2)7-8-20(15,16)3/h9,12,16-18,21-24H,4-8,10-11H2,1-3H3/t12?,16-,17-,18+,19-,20-/m0/s1
InChIKeyMLRHGLBUEINMPQ-YHBQPRGJSA-N
Species of MetaboliteComponentSourceComments
Coprinus (ncbitaxon:5345) - PubMed (22521133)
ChEBI Ontology
Outgoing Relation(s)
Radianspene D (CHEBI:224258) is a organic hydroxy compound (CHEBI:33822)
IUPAC Name 
(1S,2R,3R,3aR,5aS)-9-(hydroxymethyl)-3-(1-hydroxypropan-2-yl)-3a,5a-dimethyl-1,2,3,4,5,6,7,8-octahydrobenzo[g]azulene-1,2-diol
Manual XrefsDatabases
32742602ChemSpider