input word = C00012877

Metabolite InformationStructural formula
Name Callitrisin
[3R-(3alpha,3aalpha,4abeta,8aalpha,9aalpha)]-3a,4,4a,5,6,8a,9,9a-Octahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(3H)-one
Formula C15H20O2
Mw 232.14632988
CAS RN 66964-62-3
C_ID C00012877 ,
InChIKey VHANAQXZAJSCOS-XOTRIRMANA-N
InChICode InChI=1S/C15H20O2/c1-9-5-4-6-15(3)8-13-11(7-12(9)15)10(2)14(16)17-13/h4,6,10-13H,1,5,7-8H2,2-3H3/t10-,11-,12-,13-,15-/m1/s1
SMILES C1(=C)[C@@H]2[C@](C=CC1)(C[C@@H]1[C@H](C2)[C@H](C(=O)O1)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCupressaceaeCallitris columellaris Ref.
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