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(3R)-3,7-dimethyl-1,6-octadien-3-yl 6-O-alpha-L-arabinopyranosyl-beta-D-glucopyranoside

PropertiesImage
MNX_IDMNXM157053 Image of MNXM157053
referencechebi:139460
formulaC21H36O10
global charge0
mol weight448.509
InChIKeyOKNPZRJNRSGKME-HUHXKEGASA-N
InChIInChI=1S/C21H36O10/c1-5-21(4,8-6-7-11(2)3)31-20-18(27)16(25)15(24)13(30-20)10-29-19-17(26)14(23)12(22)9-28-19/h5,7,12-20,22-27H,1,6,8-10H2,2-4H3/t12-,13+,14-,15+,16-,17+,18+,19-,20-,21-/m0/s1
SMILESC=C[C@@](C)(CCC=C(C)C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O
MNX internals
InChI (mnx)InChI=1/C21H36O10/c1-5-21(4,8-6-7-11(2)3)31-20-18(27)16(25)15(24)13(30-20)10-29-19-17(26)14(23)12(22)9-28-19/h5,7,12-20,22-27H,1,6,8-10H2,2-4H3/t12-,13+,14-,15+,16-,17+,18+,19-,20-,21-/m0/s1 Image of MNXM157053
SMILES (mnx)[CH2:1]=[CH:5][C@@:21]([CH3:4])([CH2:8][CH2:6][CH:7]=[C:11]([CH3:2])[CH3:3])[O:31][C@H:20]1[C@H:18]([OH:27])[C@@H:16]([OH:25])[C@H:15]([OH:24])[C@@H:13]([CH2:10][O:29][C@H:19]2[C@H:17]([OH:26])[C@@H:14]([OH:23])[C@@H:12]([OH:22])[CH2:9][O:28]2)[O:30]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:139460
chebi:139460
OKNPZRJNRSGKME-HUHXKEGASA-N 		(3R)-3,7-dimethyl-1,6-octadien-3-yl 6-O-alpha-L-arabinopyranosyl-beta-D-glucopyranoside

CHEBI:168249
chebi:168249
OKNPZRJNRSGKME-UHFFFAOYSA-N 		L-Linalool 3-[xylosyl-(1->6)-glucoside]
2-(3,7-dimethylocta-1,6-dien-3-yloxy)-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol
hmdb:HMDB0030421
OKNPZRJNRSGKME-UHFFFAOYSA-N 		L-Linalool 3-[xylosyl-(1->6)-glucoside]
2-[(3,7-dimethylocta-1,6-dien-3-yl)oxy]-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxane-3,4,5-triol
Neohancoside a

hmdb:HMDB30421 		secondary/obsolete/fantasy identifier