input word = C00053924

Metabolite InformationStructural formula
Name Carissanol
Formula C20H24O7
Mw 376.15220312
CAS RN 87402-76-4
C_ID C00053924
InChIKey LHQJDCXEZZAFKD-UHFFFAOYSA-N
InChICode InChI=1S/C20H24O7/c1-25-17-8-12(3-5-15(17)21)7-14-11-27-19(23)20(14,24)10-13-4-6-16(22)18(9-13)26-2/h3-6,8-9,14,19,21-24H,7,10-11H2,1-2H3
SMILES COc1cc(CC2COC(O)C2(O)Cc2ccc(O)c(OC)c2)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCarissa edulis Ref.
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OrganismCarissa edulis
ReferenceAchenbach, H. et al., Phytochemistry, 1983, 22, 749 (isol, struct)