input word = C00036136

Metabolite InformationStructural formula
Name Manassantin A
(-)-Manassantin A
Formula C42H52O11
Mw 732.3509625
CAS RN 88497-87-4
C_ID C00036136 ,
InChIKey ZGXXNVOBEIRACL-LJLMIKCGNA-N
InChICode InChI=1S/C42H52O11/c1-23-24(2)42(30-14-18-34(38(22-30)50-10)52-26(4)40(44)28-12-16-32(46-6)36(20-28)48-8)53-41(23)29-13-17-33(37(21-29)49-9)51-25(3)39(43)27-11-15-31(45-5)35(19-27)47-7/h11-26,39-44H,1-10H3/t23-,24-,25+,26+,39-,40-,41+,42+/m0/s1
SMILES [C@@H]1([C@H]([C@@H]([C@@H](O1)c1ccc(c(c1)OC)O[C@@H]([C@@H](c1cc(c(cc1)OC)OC)O)C)C)C)c1cc(c(cc1)O[C@@H]([C@@H](c1ccc(c(c1)OC)OC)O)C)OC
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