input word = C00040111

Metabolite InformationStructural formula
Name Pubeside B
Formula C26H44O8
Mw 484.30361838
CAS RN 335150-88-4
C_ID C00040111 ,
InChIKey BINZUKMAXBYQAN-ZKXFRKSNNA-N
InChICode InChI=1S/C26H44O8/c1-24(19(29)13-28)10-7-16-15(11-24)5-6-18-25(2,8-4-9-26(16,18)3)14-33-23-22(32)21(31)20(30)17(12-27)34-23/h11,16-23,27-32H,4-10,12-14H2,1-3H3/t16-,17-,18-,19+,20-,21+,22-,23-,24+,25+,26+/m1/s1
SMILES C[C@@]1(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CCC[C@@]2(C)[C@@H]3CC[C@](C)([C@@H](O)CO)C=C3CC[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeWollastonia biflora Ref.
--Siegesbeckia orientalis Ref.
--Siegesbeckia orientalis var.pubescens Ref.
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OrganismSiegesbeckia orientalis
ReferenceLiang, et al., Fundamental Research on Common Traditional Chinese Medicines. Vol.2. Science Press, Beijing, (2007).

GIANG, et al., Chem Pharm Bull, 53, (2005), 232.

Xiang, et al., JNP, 67, (2004), 1517