input word = C00033308

Metabolite InformationStructural formula
Name Pisumoside A
(-)-Pisumoside A
Formula C38H62O21
Mw 854.37835905
CAS RN 333334-42-2
C_ID C00033308 ,
InChIKey KOGDNIPXKVTMKI-MGSLKCRXNA-N
InChICode InChI=1S/C38H62O21/c1-35-5-3-6-36(2,34(52)59-33-28(24(47)21(44)17(11-41)57-33)58-32-26(49)23(46)20(43)16(10-40)56-32)29(35)27(50)30(51)37-8-14(38(53,13-37)7-4-18(35)37)12-54-31-25(48)22(45)19(42)15(9-39)55-31/h14-33,39-51,53H,3-13H2,1-2H3/t14-,15+,16+,17+,18-,19+,20+,21+,22-,23-,24-,25+,26+,27-,28+,29-,30-,31+,32-,33-,35-,36+,37-,38-/m0/s1
SMILES C1C[C@]([C@@H]2[C@@](C1)([C@H]1[C@@]3([C@H]([C@H]2O)O)C[C@@](CC1)([C@@H](C3)CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)C)(C(=O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O)CO)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaePisum sativum L. Ref.
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