input word = C00037020

Metabolite InformationStructural formula
Name Delevoyin C
Formula C38H48O13
Mw 712.30949162
CAS RN 266000-15-1
C_ID C00037020 ,
InChIKey MTISXCFAIKDIRG-NMXCGZCANA-N
InChICode InChI=1S/C38H48O13/c1-17(2)34(45)51-33-28(48-19(4)40)30-35(7,8)25(47-18(3)39)10-11-37(30)16-38(33)14-23-13-24(43)27(22-12-26(44)46-15-22)36(23,9)32(50-21(6)42)29(31(37)38)49-20(5)41/h10-11,13,17,22,25,27-33H,12,14-16H2,1-9H3/t22-,25+,27+,28+,29-,30-,31+,32-,33+,36+,37+,38+/m0/s1
SMILES CC(=O)O[C@H]1[C@@H](OC(=O)C(C)C)[C@@]23CC4=CC(=O)[C@@H](C5COC(=O)C5)[C@]4(C)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]2[C@]2(C=C[C@@H](OC(C)=O)C(C)(C)[C@H]12)C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeEntandrophragma delevoyi Ref.
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