input word = C00020131

Metabolite InformationStructural formula
Name 3-Acetoxy-2-hydroxycalamenene
Formula C17H24O3
Mw 276.17254463
CAS RN
C_ID C00020131 ,
InChIKey MSPKEIFEKRLUPV-RLQDDWLSNA-N
InChICode InChI=1S/C17H24O3/c1-9(2)13-7-6-10(3)15-14(13)8-11(4)17(16(15)19)20-12(5)18/h8-10,13,19H,6-7H2,1-5H3/t10-,13-/m0/s1
SMILES CC(=O)Oc1c(C)cc2c(c1O)[C@@H](C)CC[C@H]2C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Lophocolea heterophylla Ref.
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