input word = C00005578

Metabolite InformationStructural formula
Name Isorhamnetin 3-apiosyl-(1->6)-glucoside-7-rhamnoside
Formula C33H40O20
Mw 756.21129372
CAS RN 115330-91-1
C_ID C00005578 ,
InChIKey IMCHSJLXDHJNGT-DAVUFDBTNA-N
InChICode InChI=1S/C33H40O20/c1-11-20(37)23(40)25(42)30(49-11)50-13-6-15(36)19-17(7-13)51-27(12-3-4-14(35)16(5-12)46-2)28(22(19)39)53-31-26(43)24(41)21(38)18(52-31)8-47-32-29(44)33(45,9-34)10-48-32/h3-7,11,18,20-21,23-26,29-32,34-38,40-45H,8-10H2,1-2H3/t11-,18+,20+,21-,23+,24-,25-,26-,29+,30+,31+,32-,33+/m1/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)CO[C@H]1[C@@H]([C@](CO1)(O)CO)O)O)O)O)c1ccc(c(c1)OC)O)O)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)C)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSantalaceaeViscum album Ref.
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