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 C1[C@@](C=C2[C@@H](C1)[C@]1([C@H](CC2)[C@@](CCC1)(CO[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)C)C)([C@H](CO)O)C
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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