input word = C00047529

Metabolite InformationStructural formula
Name Nervilifordin E
(-)-Nervilifordin E
Formula C34H42O22
Mw 802.21677303
CAS RN 1149669-53-3
C_ID C00047529 ,
InChIKey UCDRIXCTPNMJDE-HLNGAACINA-N
InChICode InChI=1S/C34H42O22/c1-49-11-5-13(39)19-15(6-11)50-29(10-2-3-14(12(38)4-10)51-32-26(46)23(43)20(40)16(7-35)52-32)31(22(19)42)56-34-28(48)25(45)30(18(9-37)54-34)55-33-27(47)24(44)21(41)17(8-36)53-33/h2-6,16-18,20-21,23-28,30,32-41,43-48H,7-9H2,1H3/t16-,17-,18-,20-,21-,23+,24+,25-,26-,27-,28-,30-,32-,33+,34+/m1/s1
SMILES COc1cc(O)c2c(=O)c(O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)c(-c3ccc(OC4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3)oc2c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeMeehania urticifolia Ref.
zoom in



OrganismMeehania urticifolia
ReferenceMurata,J.Nat.Prod.,72,(2009),1049