input word = C00043043

Metabolite InformationStructural formula
Name Strychoside A
(-)-Strychoside A
Formula C33H44O19
Mw 744.24767923
CAS RN 868171-32-8
C_ID C00043043 ,
InChIKey CQRSHECOOIXIBJ-NPBPFOLZNA-N
InChICode InChI=1S/C33H44O19/c1-4-14-16(17(29(45)46-3)11-47-30(14)51-32-26(41)24(39)22(37)19(9-35)49-32)7-6-13(8-34)21-15(5-2)31(48-12-18(21)28(43)44)52-33-27(42)25(40)23(38)20(10-36)50-33/h4-6,8,11-12,14-16,19-27,30-33,35-42H,1-2,7,9-10H2,3H3,(H,43,44)/b13-6-/t14-,15+,16?,19-,20-,21-,22-,23-,24+,25+,26-,27-,30+,31-,32+,33+/m1/s1
SMILES C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1C/C=C(/C=O)[C@@H]1C(C(=O)O)=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1C=C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLonganiaceaeStrychnos spinosa Ref.
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