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7-Hydroxy-4-methylphthalide O-[arabinosyl-(1->6)-glucoside]

PropertiesImage
MNX_IDMNXM118555 Image of MNXM118555
referencechebi:197278
formulaC20H26O12
global charge0
mol weight458.416
InChIKeyQSTWATBAAMDBSL-UHFFFAOYSA-N
InChIInChI=1S/C20H26O12/c1-7-2-3-10(12-8(7)4-28-18(12)27)31-20-17(26)15(24)14(23)11(32-20)6-30-19-16(25)13(22)9(21)5-29-19/h2-3,9,11,13-17,19-26H,4-6H2,1H3
SMILESCC1=CC=C(OC2OC(COC3OCC(O)C(O)C3O)C(O)C(O)C2O)C2=C1COC2=O
MNX internals
InChI (mnx)InChI=1/C20H26O12/c1-7-2-3-10(12-8(7)4-28-18(12)27)31-20-17(26)15(24)14(23)11(32-20)6-30-19-16(25)13(22)9(21)5-29-19/h2-3,9,11,13-17,19-26H,4-6H2,1H3/t9?,11?,13?,14?,15?,16?,17?,19?,20? Image of MNXM118555
SMILES (mnx)[CH3:1][C:7]1=[C:8]2[CH2:4][O:28][C:18](=[O:27])[C:12]2=[C:10]([O:31][CH:20]2[CH:17]([OH:26])[CH:15]([OH:24])[CH:14]([OH:23])[CH:11]([CH2:6][O:30][CH:19]3[CH:16]([OH:25])[CH:13]([OH:22])[CH:9]([OH:21])[CH2:5][O:29]3)[O:32]2)[CH:3]=[CH:2]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:197278
chebi:197278
QSTWATBAAMDBSL-UHFFFAOYSA-N
7-Hydroxy-4-methylphthalide O-[arabinosyl-(1->6)-glucoside]
4-methyl-7-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxan-2-yl]oxy-3H-2-benzouran-1-one
hmdb:HMDB0041336
QSTWATBAAMDBSL-UHFFFAOYSA-N
7-Hydroxy-4-methylphthalide O-[arabinosyl-(1->6)-glucoside]
4-methyl-7-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-1,3-dihydro-2-benzofuran-1-one
4-methyl-7-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-3H-2-benzofuran-1-one

hmdb:HMDB41336
secondary/obsolete/fantasy identifier