input word = C00034945

Metabolite InformationStructural formula
Name Petalostigmone C
(+)-Petalostigmone C
Formula C20H28O2
Mw 300.20893014
CAS RN 913059-58-2
C_ID C00034945 ,
InChIKey BHDFZMZJKYJOTB-LIRHQLPLNA-N
InChICode InChI=1S/C20H28O2/c1-6-18(3)11-14-7-8-19(4)13(2)9-15(21)10-16(19)20(14,5)12-17(18)22/h6,9-10,14,17,22H,1,7-8,11-12H2,2-5H3/t14-,17+,18+,19-,20-/m0/s1
SMILES C=C[C@]1(C)C[C@@H]2CC[C@@]3(C)C(C)=CC(=O)C=C3[C@@]2(C)C[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePicrodendraceaePetalostigma pubescens Ref.
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OrganismPetalostigma pubescens
ReferenceGrace,Phytochem.,67,(2006),1708