input word = C00058599

Metabolite InformationStructural formula
Name Longifloroside D
Formula C43H56O21
Mw 908.33140885
CAS RN 193967-33-8
C_ID C00058599
InChIKey ISSOSWMYXNUMCA-FKOIZJOSSA-N
InChICode InChI=1S/C43H56O21/c1-55-25-8-17(5-6-24(25)61-42-37(53)35(51)33(49)29(13-45)62-42)39-22-15-60-40(23(22)16-59-39)19-7-20(32(48)26(11-19)56-2)21(12-44)31(47)18-9-27(57-3)41(28(10-18)58-4)64-43-38(54)36(52)34(50)30(14-46)63-43/h5-11,21-23,29-31,33-40,42-54H,12-16H2,1-4H3/t21?,22-,23-,29+,30+,31?,33+,34+,35-,36-,37+,38+,39+,40+,42+,43-/m0/s1
SMILES COc1cc([C@H]2OC[C@H]3[C@@H]2CO[C@@H]3c2cc(OC)c(O)c(C(CO)C(O)c3cc(OC)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)c2)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOrobanchaceaePedicularis alaschanica Ref.
PlantaeOrobanchaceaePedicularis chinensis Ref.
PlantaeOrobanchaceaePedicularis lasiophrys Ref.
PlantaeOrobanchaceaePedicularis longiflora Ref.
PlantaeOrobanchaceaePedicularis plicata Ref.
PlantaeOrobanchaceaePedicularis procera Ref.
PlantaeOrobanchaceaePedicularis semitorta Ref.
PlantaeOrobanchaceaePedicularis spicata Ref.
PlantaeOrobanchaceaePedicularis striata Ref.
PlantaeOrobanchaceaePedicularis striata pall ssp. arachnoidea Ref.
PlantaeOrobanchaceaePedicularis striata subsp. arachnoides Ref.
PlantaeOrobanchaceaePedicularis torta Ref.
PlantaeOrobanchaceaePedicularis verticillata Ref.
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