input word = C00036137

Metabolite InformationStructural formula
Name Manassantin B
(-)-Manassantin B
Formula C41H48O11
Mw 716.31966238
CAS RN 88497-88-5
C_ID C00036137 ,
InChIKey GSWZMFDCPMPHDL-VTTSNVLANA-N
InChICode InChI=1S/C41H48O11/c1-22-23(2)41(29-12-16-33(36(20-29)47-8)51-25(4)39(43)27-10-14-31-37(18-27)49-21-48-31)52-40(22)28-11-15-32(35(19-28)46-7)50-24(3)38(42)26-9-13-30(44-5)34(17-26)45-6/h9-20,22-25,38-43H,21H2,1-8H3/t22-,23+,24-,25-,38+,39+,40+,41-/m1/s1
SMILES COc1ccc([C@@H](O)[C@@H](C)Oc2ccc([C@H]3O[C@H](c4ccc(O[C@H](C)[C@H](O)c5ccc6c(c5)OCO6)c(OC)c4)[C@H](C)[C@H]3C)cc2OC)cc1OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSaururaceaeHouttuynia cordata Ref.
PlantaeSaururaceaeSaururus cernuus Ref.
PlantaeSaururaceaeSaururus chinensis Ref.
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OrganismHouttuynia cordata
ReferenceHwang, et al., Phytochemistry, 64, (2003), 765.

Rho, et al., Planta Med, 69, (2003), 1147.

Ma, et al., China Journal of Chinese Materia Medica(Zhongguo Zhongyao Zazhi), 28, (2003), 196