input word = C00040294

Metabolite InformationStructural formula
Name Shizukaol D
Formula C33H38O9
Mw 578.25158281
CAS RN 142279-42-3
C_ID C00040294 ,
InChIKey UEHIWILSQZCXQY-LMBSCLPQNA-N
InChICode InChI=1S/C33H38O9/c1-12(29(38)40-5)24-26-25-16(14-6-20(14)32(25,4)28(37)27(24)36)8-23-31(3)19-7-15(19)18(11-41-13(2)35)21(31)9-22-17(10-34)30(39)42-33(22,23)26/h14-15,18-21,23,26,28,34,37H,6-11H2,1-5H3/b24-12-/t14-,15-,18-,19-,20-,21+,23+,26+,28+,31+,32+,33+/m1/s1
SMILES COC(=O)/C(C)=C1C(=O)[C@H](O)[C@]2(C)C3=C(C[C@@H]4[C@]5(OC(=O)C(CO)=C5C[C@H]5[C@H](COC(C)=O)[C@H]6C[C@H]6[C@]45C)[C@H]31)[C@H]1C[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeChloranthaceaeChloranthus fortunei Ref.
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OrganismChloranthus fortunei
ReferenceWang,J.Nat.Prod.,71,(2008),674