input word = C00022424

Metabolite InformationStructural formula
Name Cistenolic acid
Formula C20H34O3
Mw 322.25079495
CAS RN 80995-92-2
C_ID C00022424 ,
InChIKey UFGJFRRXTBBPQS-TUFKGFNTNA-N
InChICode InChI=1S/C20H34O3/c1-13(11-18(22)23)7-8-15-14(2)16(21)12-17-19(3,4)9-6-10-20(15,17)5/h13,15-17,21H,2,6-12H2,1,3-5H3,(H,22,23)/t13-,15-,16+,17-,20-/m0/s1
SMILES C1CC([C@H]2[C@@](C1)([C@H](C(=C)[C@@H](C2)O)CC[C@@H](CC(=O)O)C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCistaceaeCistus symphytifolius Ref.
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OrganismCistus symphytifolius
ReferenceCalabuig,Phytochem.,20,(1981),2255