input word = C00003113

Metabolite InformationStructural formula
Name Centarol
Formula C15H26O2
Mw 238.19328007
CAS RN 57308-24-4
C_ID C00003113 ,
InChIKey NUXLUAXOQWMFEE-LRPXSDCBNA-N
InChICode InChI=1S/C15H26O2/c1-10-6-7-11-12(13(10)16)14(2,3)8-5-9-15(11,4)17/h6,11-13,16-17H,5,7-9H2,1-4H3/t11-,12-,13+,15+/m1/s1
SMILES CC1=CC[C@@H]2[C@H]([C@H]1O)C(C)(C)CCC[C@]2(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaeCedrus deodara Ref.
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OrganismCedrus deodara
ReferenceKulshreshtha,Phytochem.,14,(1975),2237