input word = C00037763

Metabolite InformationStructural formula
Name Safghanoside F
(-)-Safghanoside F
Formula C38H48O18
Mw 792.28406473
CAS RN 482648-21-5
C_ID C00037763 ,
InChIKey LIZINHINKPEWIG-PSGCYOHRNA-N
InChICode InChI=1S/C38H48O18/c1-2-23-24(15-28(42)52-18-27-30(44)32(46)33(47)37(55-27)51-14-12-20-5-9-22(41)10-6-20)25(35(49)50-13-11-19-3-7-21(40)8-4-19)17-53-36(23)56-38-34(48)31(45)29(43)26(16-39)54-38/h2-10,17,24,26-27,29-34,36-41,43-48H,11-16,18H2,1H3/b23-2+/t24-,26-,27-,29-,30-,31+,32+,33-,34-,36+,37-,38+/m1/s1
SMILES C1(=CO[C@H](/C(=C/C)/[C@H]1CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](OCCc2ccc(cc2)O)O1)O)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)C(=O)OCCc1ccc(cc1)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOleaceaeSyringa afghanica Ref.
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OrganismSyringa afghanica
ReferenceTakenaka,Phytochem.,59,(2002),779