input word = C00035568

Metabolite InformationStructural formula
Name Crolechinic acid
Formula C20H30O3
Mw 318.21949482
CAS RN 148302-74-3
C_ID C00035568 ,
InChIKey NTRSOYPAPOGZQP-GCGZLWQCNA-N
InChICode InChI=1S/C20H30O3/c1-14-7-10-20(3)16(18(21)22)5-4-6-17(20)19(14,2)11-8-15-9-12-23-13-15/h9,12-14,16-17H,4-8,10-11H2,1-3H3,(H,21,22)/t14-,16+,17-,19+,20-/m1/s1
SMILES C[C@@H]1CC[C@]2(C)[C@H](CCC[C@H]2C(=O)O)[C@@]1(C)CCc1ccoc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeCroton lechleri Mull.Arg. Ref.
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