input word = C00057546

Metabolite InformationStructural formula
Name 17-Oxo-15-kauren-19-oic acid
Formula C20H28O3
Mw 316.20384476
CAS RN 77887-58-2
C_ID C00057546
InChIKey DIURMAFIAYOVGU-PMHNSBFUSA-N
InChICode InChI=1S/C20H28O3/c1-18-7-3-8-19(2,17(22)23)15(18)6-9-20-10-13(4-5-16(18)20)14(11-20)12-21/h11-13,15-16H,3-10H2,1-2H3,(H,22,23)/t13-,15+,16+,18-,19-,20+/m1/s1
SMILES C[C@@]12CCC[C@@](C)(C(=O)O)[C@H]1CC[C@]13C=C(C=O)[C@H](CC[C@H]12)C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelianthus spp. Ref.
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