input word = C00053393

Metabolite InformationStructural formula
Name Karavoate F
Formula C39H64O5
Mw 612.47537515
CAS RN 1269766-59-7
C_ID C00053393
InChIKey GCSGWQIIVZDSSY-FQJWPJOCSA-N
InChICode InChI=1S/C39H64O5/c1-12-14-33(40)43-27(22-25(3)4)23-26(5)28-18-19-39(10)35-31(42-11)24-30-29(37(35,8)20-21-38(28,39)9)16-17-32(36(30,6)7)44-34(41)15-13-2/h22,24,26-29,31-32,35H,12-21,23H2,1-11H3/t26-,27+,28-,29-,31+,32+,35-,37+,38-,39+/m1/s1
SMILES CCCC(=O)O[C@H]1CC[C@@H]2C(=C[C@H](OC)[C@@H]3[C@@]2(C)CC[C@]2(C)[C@@H]([C@H](C)C[C@H](C=C(C)C)OC(=O)CCC)CC[C@@]32C)C1(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeMomordica balsamina Ref.
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OrganismMomordica balsamina
ReferenceRamalhete, C. et al., Bioorg. Med. Chem., 24, (2016), 5061-5067.