input word = C00043124

Metabolite InformationStructural formula
Name Zumketol
(-)-Zumketol
Formula C30H36O9
Mw 540.23593275
CAS RN 848579-24-8
C_ID C00043124 ,
InChIKey FTSWGUUXZGNMSV-YSKCAENSNA-N
InChICode InChI=1S/C30H36O9/c1-14(31)37-23-24-29(6,21(34)12-20-27(3,4)39-22-11-18(33)25(35)30(20,22)24)19-8-7-17(16-9-10-36-13-16)28(19,5)26(23)38-15(2)32/h8-10,13,17-18,20,22-24,26,33H,7,11-12H2,1-6H3/t17-,18-,20-,22-,23+,24-,26-,28-,29+,30-/m0/s1
SMILES [C@H]1([C@H]2[C@](C3=CC[C@H]([C@@]3([C@H]1OC(=O)C)C)c1cocc1)(C(=O)C[C@@H]1[C@@]32[C@@H](OC1(C)C)C[C@@H](C3=O)O)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeCroton jatrophoides Ref.
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OrganismCroton jatrophoides
ReferenceNihei,J.Nat.Prod.,68,(2005),244