input word = C00047527

Metabolite InformationStructural formula
Name Nervilifordin C
(-)-Nervilifordin C
Formula C28H32O17
Mw 640.1639496
CAS RN 1149669-51-1
C_ID C00047527 ,
InChIKey LSPBTBSEMHJXDA-AZTRMXDKNA-N
InChICode InChI=1S/C28H32O17/c1-40-10-5-13(33)17-14(6-10)41-24(9-2-3-11(31)12(32)4-9)26(19(17)35)45-28-23(39)21(37)25(16(8-30)43-28)44-27-22(38)20(36)18(34)15(7-29)42-27/h2-6,15-16,18,20-23,25,27-34,36-39H,7-8H2,1H3/t15-,16-,18-,20+,21-,22-,23-,25-,27+,28+/m1/s1
SMILES c12c(c(=O)c(c(o1)c1ccc(c(c1)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)O)O)c(cc(c2)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeMeehania urticifolia Ref.
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OrganismMeehania urticifolia
ReferenceMurata,J.Nat.Prod.,72,(2009),1049