input word = C00012522

Metabolite InformationStructural formula
Name Grimaldone
Formula C15H22O
Mw 218.16706532
CAS RN 58856-96-5
C_ID C00012522 ,
InChIKey BSSOGAHRTAIVJR-ZVBWLBPENA-N
InChICode InChI=1S/C15H22O/c1-10-5-8-15(9-11(10)15)14(4)7-6-12(16)13(14,2)3/h11H,1,5-9H2,2-4H3/t11-,14-,15+/m1/s1
SMILES C1[C@](C(C(=O)C1)(C)C)([C@@]12[C@@H](C(=C)CC1)C2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSimaroubaceaeMannia fragrans Ref.
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OrganismMannia fragrans
ReferenceHuneck,Phytochem.,27,(1988),1405