input word = C00002642

Metabolite InformationStructural formula
Name Cannabidiolic acid
Formula C22H30O4
Mw 358.21440945
CAS RN 1244-58-2
C_ID C00002642 ,
InChIKey WVOLTBSCXRRQFR-LQKAMQBPNA-N
InChICode InChI=1S/C22H30O4/c1-5-6-7-8-15-12-18(23)20(21(24)19(15)22(25)26)17-11-14(4)9-10-16(17)13(2)3/h11-12,16-17,23-24H,2,5-10H2,1,3-4H3,(H,25,26)/t16-,17-/m0/s1
SMILES c1(c(cc(c(c1O)C(=O)O)CCCCC)O)[C@H]1C=C(CC[C@H]1C(=C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCannabaceaeCannabis indica Ref.
PlantaeCannabaceaeCannabis inflorescences Ref.
PlantaeCannabaceaeCannabis sativa var. indica Ref.
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