input word = C00063831

Metabolite InformationStructural formula
Name Chionoside J
Formula C35H46O21
Mw 802.25315854
CAS RN 1370465-09-0
C_ID C00063831
InChIKey JVQHQYBRAHEGCM-XKWGDXKXSA-N
InChICode InChI=1S/C35H46O21/c36-11-20-24(44)26(46)28(48)34(51-20)56-32-27(47)25(45)21(12-37)52-35(32)55-31-29(49)33(50-8-7-15-2-5-17(40)19(42)10-15)53-22(13-38)30(31)54-23(43)6-3-14-1-4-16(39)18(41)9-14/h1-6,9-10,20-22,24-42,44-49H,7-8,11-13H2/b6-3+/t20-,21-,22-,24-,25-,26+,27+,28-,29-,30-,31-,32-,33-,34+,35+/m1/s1
SMILES O=C(C=Cc1ccc(O)c(O)c1)OC1C(CO)OC(OCCc2ccc(O)c(O)c2)C(O)C1OC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePlantaginaceaeVeronica beccabunga Ref.
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