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CHEBI:220051 - Davotremulane B

ChEBI IDCHEBI:220051
ChEBI NameDavotremulane B
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FormulaC15H22O4
Net Charge0
Average Mass266.337
Monoisotopic Mass266.15181
SMILESC[C@@H]1[C@H]2C[C@](C)(CO)C[C@H]2C2=C(C[C@H]1O)C(=O)OC2
InChIInChI=1S/C15H22O4/c1-8-10-4-15(2,7-16)5-11(10)12-6-19-14(18)9(12)3-13(8)17/h8,10-11,13,16-17H,3-7H2,1-2H3/t8-,10-,11-,13-,15+/m1/s1
InChIKeyJWJXTTYKJTWOMU-XEPQBVIJSA-N
ChEBI Ontology
Outgoing Relation(s)
Davotremulane B (CHEBI:220051) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(5R,6R,6aS,8S,9aR)-5-hydroxy-8-(hydroxymethyl)-6,8-dimethyl-1,4,5,6,6a,7,9,9a-octahydroazuleno[4,5-c]uran-3-one
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