input word = C00038194

Metabolite InformationStructural formula
Name 1-O-Acetyltrichilin H
(-)-1-O-Acetyltrichilin H
Formula C38H48O15
Mw 744.29932087
CAS RN 181799-11-1
C_ID C00038194 ,
InChIKey SLEYQPAPEGEFEM-ICJAZXEQNA-N
InChICode InChI=1S/C38H48O15/c1-16(2)32(45)52-33-34(7)23-13-24(43)36(9)28(37(23,15-47-33)31(51-20(6)42)27(48-17(3)39)30(34)50-19(5)41)26(44)29(49-18(4)40)35(8)22(21-10-11-46-14-21)12-25-38(35,36)53-25/h10-11,14,16,22-25,27-31,33,43H,12-13,15H2,1-9H3/t22-,23-,24+,25+,27-,28-,29-,30+,31-,33-,34+,35+,36+,37-,38?/m0/s1
SMILES CC(=O)O[C@H]1[C@@H](OC(C)=O)C2(C)[C@H](OC(=O)C(C)C)OC[C@]3([C@H]4C(=O)[C@H](OC(C)=O)[C@@]5(C)[C@H](c6ccoc6)C[C@H]6O[C@]65[C@]4(C)[C@H](O)C[C@@H]23)[C@H]1OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeMelia toosendan Ref.
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