input word = C00032874

Metabolite InformationStructural formula
Name Cussosaponin C
(-)-Cussosaponin C
Formula C59H96O25
Mw 1204.62406862
CAS RN 366814-42-8
C_ID C00032874 ,
InChIKey RLVCFPDMEANTCJ-OWWFPDFINA-N
InChICode InChI=1S/C59H96O25/c1-23(2)26-12-17-59(54(74)84-52-45(72)41(68)38(65)30(80-52)22-76-49-46(73)42(69)47(29(20-60)79-49)82-50-43(70)39(66)35(62)24(3)77-50)19-18-57(8)27(34(26)59)10-11-32-56(7)15-14-33(55(5,6)31(56)13-16-58(32,57)9)81-53-48(37(64)28(61)21-75-53)83-51-44(71)40(67)36(63)25(4)78-51/h24-53,60-73H,1,10-22H2,2-9H3/t24-,25+,26-,27+,28-,29+,30+,31-,32+,33-,34-,35-,36-,37-,38+,39+,40-,41-,42-,43+,44+,45+,46+,47+,48+,49+,50-,51?,52-,53-,56-,57+,58+,59-/m0/s1
SMILES [C@@]12([C@H]([C@@H]3[C@@](CC1)([C@]1([C@H](CC3)[C@@]3([C@@H](CC1)C([C@H](CC3)O[C@@H]1OC[C@@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)C)O)O)O)O)O)(C)C)C)C)C)[C@@H](CC2)C(=C)C)C(=O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)CO)O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaeCussonia racemosa BAKER Ref.
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OrganismCussonia racemosa BAKER
ReferenceHarinantenaina,Chem.Pharm.Bull.,50,(2002),1290