input word = C00037769

Metabolite InformationStructural formula
Name Saletpangponoside B
(-)-Saletpangponoside B
Formula C34H44O19
Mw 756.24767923
CAS RN 379733-67-2
C_ID C00037769 ,
InChIKey HHIBYENHLKOCEO-ZZKOLOCFNA-N
InChICode InChI=1S/C34H44O19/c1-14(37)53-34(2)10-18(22-17(30(45)46-3)13-47-31(23(22)34)52-33-29(44)27(42)25(40)20(12-36)51-33)49-21(38)9-6-15-4-7-16(8-5-15)48-32-28(43)26(41)24(39)19(11-35)50-32/h4-9,13,18-20,22-29,31-33,35-36,39-44H,10-12H2,1-3H3/b9-6-/t18-,19-,20-,22+,23-,24-,25-,26+,27+,28-,29-,31+,32-,33+,34+/m1/s1
SMILES O1C=C([C@@H]2[C@H]([C@@H]1O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)[C@@](C[C@H]2OC(=O)/C=C\c1ccc(cc1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)(C)OC(=O)C)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeBarleria lupulina Ref.
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