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CHEBI:211086 - (1R,6R,11R)-6-hydroxydolabella-3E,7E,12-trien-14-one

ChEBI IDCHEBI:211086
ChEBI Name(1R,6R,11R)-6-hydroxydolabella-3E,7E,12-trien-14-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H30O2
Net Charge0
Average Mass302.458
Monoisotopic Mass302.22458
SMILESCC1=C[C@H](O)C/C(C)=C/C[C@@]2(C)C(=O)C=C(C(C)C)C2CC1
InChIInChI=1S/C20H30O2/c1-13(2)17-12-19(22)20(5)9-8-15(4)11-16(21)10-14(3)6-7-18(17)20/h8,10,12-13,16,18,21H,6-7,9,11H2,1-5H3/b14-10?,15-8+/t16-,18?,20+/m0/s1
InChIKeyHQCVRJOFBONDTQ-MKBISQENSA-N
Species of MetaboliteComponentSourceComments
Stachybotrys (ncbitaxon:74721) - DOI (10.1016/j.tet.2017.11.006)
ChEBI Ontology
Outgoing Relation(s)
(1R,6R,11R)-6-hydroxydolabella-3E,7E,12-trien-14-one (CHEBI:211086) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(3aR,5E,8R)-8-hydroxy-3a,6,10-trimethyl-1-propan-2-yl-4,7,8,11,12,12a-hexahydrocyclopenta[11]annulen-3-one