input word = C00036973

Metabolite InformationStructural formula
Name Cussoside B
(-)-Cussoside B
Formula C32H54O13
Mw 646.35644181
CAS RN 461024-91-9
C_ID C00036973 ,
InChIKey MKMAHELGRJTPPQ-NRRASVOGNA-N
InChICode InChI=1S/C32H54O13/c1-17-7-11-32(16-43-30-28(41)26(39)24(37)21(15-35)45-30)18(2)5-4-6-22(32)31(17,3)10-8-19(13-33)9-12-42-29-27(40)25(38)23(36)20(14-34)44-29/h5,9,17,20-30,33-41H,4,6-8,10-16H2,1-3H3/b19-9-/t17-,20-,21-,22-,23-,24-,25+,26+,27-,28-,29-,30-,31+,32-/m1/s1
SMILES C1[C@H]([C@@]([C@@H]2[C@@](C1)(C(=CCC2)C)CO[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)(CC/C(=C/CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)/CO)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaeCussonia racemosa Ref.
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OrganismCussonia racemosa
ReferenceLiva,Phytochem.,60,(2002),339