input word = C00043768

Metabolite InformationStructural formula
Name Nephelioside V
(+)-Nephelioside V
Formula C46H76O15
Mw 868.51842176
CAS RN 656253-26-8
C_ID C00043768 ,
InChIKey OHNDWYDTYQVTSN-DXMNUUCTNA-N
InChICode InChI=1S/C46H76O15/c1-41(2)15-16-43(5)23(17-41)22-9-10-28-44(6)13-12-30(42(3,4)27(44)11-14-45(28,7)46(22,8)18-29(43)50)59-40-37(61-39-35(55)33(53)32(52)26(19-47)58-39)36(25(49)21-57-40)60-38-34(54)31(51)24(48)20-56-38/h9,23-40,47-55H,10-21H2,1-8H3/t23-,24-,25+,26+,27-,28+,29-,30-,31-,32+,33-,34+,35+,36-,37+,38-,39-,40-,43-,44-,45+,46+/m0/s1
SMILES C1[C@]2([C@H](C([C@H](C1)O[C@@H]1OC[C@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O[C@@H]1OC[C@@H]([C@@H]([C@H]1O)O)O)O)(C)C)CC[C@@]1([C@@H]2CC=C2[C@]1(C[C@@H]([C@@]1([C@H]2CC(CC1)(C)C)C)O)C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSapindaceaeNephelium maingayi Ref.
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OrganismNephelium maingayi
ReferenceIto,J.Nat.Prod.,67,(2004),201