input word = C00050784

Metabolite InformationStructural formula
Name ent-18-Hydroxytrachyloban-3-one
Formula C20H30O12
Mw 462.17372642
CAS RN 718640-88-1
C_ID C00050784
InChIKey GEANNTVLCDDBTE-MRYHVDLRNA-N
InChICode InChI=1S/C20H30O2/c1-17-6-5-16(22)19(3,11-21)14(17)4-7-20-9-13-12(8-15(17)20)18(13,2)10-20/h12-15,21H,4-11H2,1-3H3/t12?,13-,14-,15-,17+,18+,19+,20-/m0/s1
SMILES CC12C[C@@]34CC[C@H]5[C@@](C)(CCC(=O)[C@]5(C)CO)[C@@H]3CC1[C@@H]2C4
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeCroton zambesicus Ref.
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