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alpha-isomaltosyl-(1->3)-isomaltose

PropertiesImage
MNX_IDMNXM164517 Image of MNXM164517
referencechebi:136823
formulaC24H42O21
global charge0
mol weight666.579
InChIKeyWUWPXNNUBKKWHD-ZPWXTSRPSA-N
InChIInChI=1S/C24H42O21/c25-1-5-9(27)14(32)17(35)22(42-5)39-4-8-11(29)15(33)18(36)24(44-8)45-20-12(30)6(2-26)43-23(19(20)37)40-3-7-10(28)13(31)16(34)21(38)41-7/h5-38H,1-4H2/t5-,6-,7-,8-,9-,10-,11-,12-,13+,14+,15+,16-,17-,18-,19-,20+,21?,22+,23+,24-/m1/s1
SMILESOC[C@H]1O[C@H](OC[C@H]2O[C@H](O[C@@H]3[C@@H](O)[C@@H](OC[C@H]4OC(O)[C@H](O)[C@@H](O)[C@@H]4O)O[C@H](CO)[C@H]3O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C24H42O21/c25-1-5-9(27)14(32)17(35)22(42-5)39-4-8-11(29)15(33)18(36)24(44-8)45-20-12(30)6(2-26)43-23(19(20)37)40-3-7-10(28)13(31)16(34)21(38)41-7/h5-38H,1-4H2/t5-,6-,7-,8-,9-,10-,11-,12-,13+,14+,15+,16-,17-,18-,19-,20+,21?,22+,23+,24-/m1/s1 Image of MNXM164517
SMILES (mnx)[CH2:1]([C@@H:5]1[C@@H:9]([OH:27])[C@H:14]([OH:32])[C@@H:17]([OH:35])[C@@H:22]([O:39][CH2:4][C@@H:8]2[C@@H:11]([OH:29])[C@H:15]([OH:33])[C@@H:18]([OH:36])[C@@H:24]([O:45][C@H:20]3[C@H:12]([OH:30])[C@@H:6]([CH2:2][OH:26])[O:43][C@H:23]([O:40][CH2:3][C@@H:7]4[C@@H:10]([OH:28])[C@H:13]([OH:31])[C@@H:16]([OH:34])[CH:21]([OH:38])[O:41]4)[C@@H:19]3[OH:37])[O:44]2)[O:42]1)[OH:25]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:136823
chebi:136823
WUWPXNNUBKKWHD-ZPWXTSRPSA-N 		alpha-isomaltosyl-(1->3)-isomaltose
alpha-D-Glc-(1->6)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->6)-D-Glc
alpha-D-Glcp-(1->6)-alpha-D-Glcp-(1->3)-alpha-D-Glcp-(1->6)-D-Glcp
alpha-D-glucopyranosyl-(1->6)-alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->6)-D-glucopyranose
alpha-D-glucosyl-(1->6)-alpha-D-glucosyl-(1->3)-alpha-D-glucosyl-(1->6)-D-glucose
alpha-Glc-(1->6)-alpha-Glc-(1->3)-alpha-Glc-(1->6)-Glc

seed.compound:cpd32824
seedM:cpd32824
WUWPXNNUBKKWHD-ZPWXTSRPSA-N 		alpha-D-glucopyranosyl-(1->6)-alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->6)-D-glucopyranose
alpha-isomaltosyl-(1->3)-isomaltose

kegg.compound:C21659
keggC:C21659
WUWPXNNUBKKWHD-ZPWXTSRPSA-N 		alpha-Isomaltosyl-1,3-isomaltose

metacyc.compound:CPD-19462
metacycM:CPD-19462
WUWPXNNUBKKWHD-ZPWXTSRPSA-N 		alpha-isomaltosyl-(1->3)-isomaltose
alpha-D-glucopyranosyl-(1->6)-alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->6)-D-glucopyranose

keggC:M_C21659
seedM:M_cpd32824 		secondary/obsolete/fantasy identifier