input word = C00036883

Metabolite InformationStructural formula
Name Cascarillin D
(-)-Cascarillin D
Formula C22H30O5
Mw 374.20932407
CAS RN 366477-63-6
C_ID C00036883 ,
InChIKey YLZPJQVMLYKGIB-SSKRXSHPNA-N
InChICode InChI=1S/C22H30O5/c1-14-17(26-15(2)24)11-20(3)18(5-6-19-21(20,4)27-19)22(14,13-23)9-7-16-8-10-25-12-16/h8,10,12-14,17-19H,5-7,9,11H2,1-4H3/t14-,17-,18+,19-,20-,21-,22-/m1/s1
SMILES [C@@H]1([C@H]([C@@]([C@@H]2[C@@](C1)([C@]1([C@@H](CC2)O1)C)C)(CCc1cocc1)C=O)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeCroton eleuteria Ref.
PlantaeEuphorbiaceaeCroton eluteria Bennett Ref.
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OrganismCroton eluteria Bennett
ReferenceVigor,Phytochem.,57,(2001),1209