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CHEBI:199168 - Cyathin B2

ChEBI IDCHEBI:199168
ChEBI NameCyathin B2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H28O2
Net Charge0
Average Mass300.442
Monoisotopic Mass300.20893
SMILESCC(C)C1=C2[C@H]3CC=C(C=O)CC(=O)[C@]3(C)CC[C@@]2(C)CC1
InChIInChI=1S/C20H28O2/c1-13(2)15-7-8-19(3)9-10-20(4)16(18(15)19)6-5-14(12-21)11-17(20)22/h5,12-13,16H,6-11H2,1-4H3/t16-,19-,20-/m1/s1
InChIKeyAVJLILJQVZOXPN-NSISKUIASA-N
Species of MetaboliteComponentSourceComments
Cyathus (ncbitaxon:68776) - DOI (10.1139/v79-543)
ChEBI Ontology
Outgoing Relation(s)
Cyathin B2 (CHEBI:199168) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(3aR,5aR,10aR)-3a,5a-dimethyl-6-oxo-1-propan-2-yl-3,4,5,7,10,10a-hexahydro-2H-cyclohepta[e]indene-8-carbaldehyde
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