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3-hydroxy-beta-ionol 3-[glucosyl-(1->6)-glucoside]

PropertiesImage
MNX_IDMNXM117461 Image of MNXM117461
referencechebi:138797
formulaC25H42O12
global charge0
mol weight534.599
InChIKeyJZJSTNWTRLNQSL-AATRIKPKSA-N
InChIInChI=1S/C25H42O12/c1-11-7-13(8-25(3,4)14(11)6-5-12(2)27)35-24-22(33)20(31)18(29)16(37-24)10-34-23-21(32)19(30)17(28)15(9-26)36-23/h5-6,12-13,15-24,26-33H,7-10H2,1-4H3/b6-5+
SMILESCC1=C(/C=C/C(C)O)C(C)(C)CC(OC2OC(COC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)C1
MNX internals
InChI (mnx)InChI=1/C25H42O12/c1-11-7-13(8-25(3,4)14(11)6-5-12(2)27)35-24-22(33)20(31)18(29)16(37-24)10-34-23-21(32)19(30)17(28)15(9-26)36-23/h5-6,12-13,15-24,26-33H,7-10H2,1-4H3/b6-5+/t12?,13?,15?,16?,17?,18?,19?,20?,21?,22?,23?,24? Image of MNXM117461
SMILES (mnx)[CH3:1][C:11]1=[C:14](/[CH:6]=[CH:5]/[CH:12]([CH3:2])[OH:27])[C:25]([CH3:3])([CH3:4])[CH2:8][CH:13]([O:35][CH:24]2[CH:22]([OH:33])[CH:20]([OH:31])[CH:18]([OH:29])[CH:16]([CH2:10][O:34][CH:23]3[CH:21]([OH:32])[CH:19]([OH:30])[CH:17]([OH:28])[CH:15]([CH2:9][OH:26])[O:36]3)[O:37]2)[CH2:7]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:138797
chebi:138797
JZJSTNWTRLNQSL-AATRIKPKSA-N
3-hydroxy-beta-ionol 3-[glucosyl-(1->6)-glucoside]
hmdb:HMDB0037527
JZJSTNWTRLNQSL-AATRIKPKSA-N
3-Hydroxy-beta-ionol 3-[glucosyl-(1->6)-glucoside]
2-({4-[(1E)-3-hydroxybut-1-en-1-yl]-3,5,5-trimethylcyclohex-3-en-1-yl}oxy)-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxane-3,4,5-triol
3-Higgp
3-Hydroxy-b-ionol 3-[glucosyl-(1->6)-glucoside]
3-Hydroxy-beta-ionol-glucopyranosyl(1-6)glucopyranoside

hmdb:HMDB37527
secondary/obsolete/fantasy identifier