input word = C00053401

Metabolite InformationStructural formula
Name Karavoate N
Formula C47H64O7
Mw 740.4652044
CAS RN 1269766-66-6
C_ID C00053401
InChIKey BRDXQCIICDEATJ-QFIBOFTBSA-N
InChICode InChI=1S/C47H64O7/c1-29(2)26-35(53-42(48)31-12-16-33(50-9)17-13-31)27-30(3)36-22-23-47(8)41-39(52-11)28-38-37(45(41,6)24-25-46(36,47)7)20-21-40(44(38,4)5)54-43(49)32-14-18-34(51-10)19-15-32/h12-19,26,28,30,35-37,39-41H,20-25,27H2,1-11H3/t30-,35+,36-,37-,39+,40+,41-,45+,46-,47+/m1/s1
SMILES COc1ccc(C(=O)O[C@H]2CC[C@@H]3C(=C[C@H](OC)[C@@H]4[C@@]3(C)CC[C@]3(C)[C@@H]([C@H](C)C[C@H](C=C(C)C)OC(=O)c5ccc(OC)cc5)CC[C@@]43C)C2(C)C)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeMomordica balsamina Ref.
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