input word = C00043928

Metabolite InformationStructural formula
Name Stansin 5
(-)-Stansin 5
Formula C50H86O21
Mw 1022.56615981
CAS RN 768399-41-3
C_ID C00043928 ,
InChIKey NBXYWBQOSAPVTP-OSMROLNINA-N
InChICode InChI=1S/C50H86O21/c1-8-11-17-20-29-21-18-15-13-12-14-16-19-22-33(52)66-41-30(23-31-34(53)36(55)40(28(7)62-31)67-45(59)25(4)9-2)27(6)63-50(44(41)68-46(60)26(5)10-3)70-42-37(56)35(54)32(24-51)65-49(42)69-43-38(57)39(58)47(61)71-48(43)64-29/h25-32,34-44,47-51,53-58,61H,8-24H2,1-7H3/t25-,26+,27-,28+,29-,30-,31-,32+,34+,35+,36-,37-,38-,39-,40+,41+,42+,43+,44-,47-,48+,49-,50-/m0/s1
SMILES [C@@H]1(O[C@@H]2[C@@H]([C@H]([C@@H]1O)O)O[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C)C[C@@H]1O[C@@H]([C@H]([C@H]([C@@H]1O)O)OC(=O)[C@H](CC)C)C)OC(=O)CCCCCCCCC[C@@H](O[C@H]1[C@H](O2)[C@H]([C@@H]([C@H](O1)O)O)O)CCCCC)OC(=O)[C@@H](CC)C)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeConvolvulaceaeIpomoea stans Ref.
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OrganismIpomoea stans
ReferenceLeon,J.Nat.Prod.,67,(2004),1552