input word = C00023517

Metabolite InformationStructural formula
Name ent-4(18)-Cleroden-15-oic acid
Formula C20H34O2
Mw 306.25588033
CAS RN 120552-38-7
C_ID C00023517 ,
InChIKey PCLLARKXULWKJD-FTJZDWMPNA-N
InChICode InChI=1S/C20H34O2/c1-14(13-18(21)22)9-11-19(4)16(3)10-12-20(5)15(2)7-6-8-17(19)20/h14,16-17H,2,6-13H2,1,3-5H3,(H,21,22)/t14-,16+,17+,19-,20-/m0/s1
SMILES C1CC(=C)[C@]2([C@H](C1)[C@@]([C@@H](CC2)C)(C)CC[C@@H](CC(=O)O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAgeratina ixiocladon Ref.
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