input word = C00020180

Metabolite InformationStructural formula
Name (1S,3R,4R)-Calamenene-3,4,7-triol
Formula C15H22O3
Mw 250.15689457
CAS RN 101688-38-4
C_ID C00020180 ,
InChIKey CBQXOSRRUVUEKT-USUSBLBENA-N
InChICode InChI=1S/C15H22O3/c1-8(2)15(18)12-5-10(4)13(16)7-11(12)9(3)6-14(15)17/h5,7-9,14,16-18H,6H2,1-4H3/t9-,14+,15+/m0/s1
SMILES c1(c(cc2c(c1)[C@H](C[C@H]([C@]2(C(C)C)O)O)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Lemnalia cervicornis Ref.
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OrganismLemnalia cervicornis
ReferenceBowden,Aust. J. Chem.,39,(1986),103