input word = C00046063

Metabolite InformationStructural formula
Name Khayanolide C
(+)-Khayanolide C
Formula C27H32O10
Mw 516.19954724
CAS RN 330846-36-1
C_ID C00046063 ,
InChIKey BXSPWNHDIUKNAJ-CELROJQONA-N
InChICode InChI=1S/C27H32O10/c1-23-7-5-13-25(3)18(17(30)22(32)35-4)24(2)11-26(25,33)19(16(29)20(24)31)27(13,34)14(23)9-15(28)37-21(23)12-6-8-36-10-12/h6,8-10,13,17-21,30-31,33-34H,5,7,11H2,1-4H3/t13-,17-,18+,19+,20-,21+,23-,24-,25-,26+,27-/m1/s1
SMILES COC(=O)[C@H](O)[C@H]1[C@@]2(C)C[C@]3(O)[C@H](C(=O)[C@H]2O)[C@]2(O)C4=CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CC[C@@H]2[C@]13C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeKhaya senegalensis Ref.
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