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maltopentaose

PropertiesImage
MNX_IDMNXM1092277 Image of MNXM1092277
referencechebi:62006
formulaC30H52O26
global charge0
mol weight828.72
InChIKeyFJCUPROCOFFUSR-GMMZZHHDSA-N
InChIInChI=1S/C30H52O26/c31-1-7(37)13(39)23(8(38)2-32)53-28-20(46)16(42)25(10(4-34)50-28)55-30-22(48)18(44)26(12(6-36)52-30)56-29-21(47)17(43)24(11(5-35)51-29)54-27-19(45)15(41)14(40)9(3-33)49-27/h1,7-30,32-48H,2-6H2/t7-,8+,9+,10+,11+,12+,13+,14+,15-,16+,17+,18+,19+,20+,21+,22+,23+,24+,25+,26+,27+,28+,29+,30+/m0/s1
SMILESO=C[C@H](O)[C@@H](O)[C@H](O[C@H]1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)CO
MNX internals
InChI (mnx)InChI=1/C30H52O26/c31-1-7(37)13(39)23(8(38)2-32)53-28-20(46)16(42)25(10(4-34)50-28)55-30-22(48)18(44)26(12(6-36)52-30)56-29-21(47)17(43)24(11(5-35)51-29)54-27-19(45)15(41)14(40)9(3-33)49-27/h1,7-30,32-48H,2-6H2/t7-,8+,9+,10+,11+,12+,13+,14+,15-,16+,17+,18+,19+,20+,21+,22+,23+,24+,25+,26+,27+,28+,29+,30+/m0/s1 Image of MNXM1092277
SMILES (mnx)[CH:1]([C@@H:7]([C@H:13]([C@@H:23]([C@@H:8]([CH2:2][OH:32])[OH:38])[O:53][C@@H:28]1[C@H:20]([OH:46])[C@@H:16]([OH:42])[C@H:25]([O:55][C@@H:30]2[C@H:22]([OH:48])[C@@H:18]([OH:44])[C@H:26]([O:56][C@@H:29]3[C@H:21]([OH:47])[C@@H:17]([OH:43])[C@H:24]([O:54][C@@H:27]4[C@H:19]([OH:45])[C@@H:15]([OH:41])[C@H:14]([OH:40])[C@@H:9]([CH2:3][OH:33])[O:49]4)[C@@H:11]([CH2:5][OH:35])[O:51]3)[C@@H:12]([CH2:6][OH:36])[O:52]2)[C@@H:10]([CH2:4][OH:34])[O:50]1)[OH:39])[OH:37])=[O:31]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)18
in models (compartimentalized) 5
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:62006
chebi:62006
FJCUPROCOFFUSR-GMMZZHHDSA-N
maltopentaose
alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-D-Glc
alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-D-glucose

bigg.metabolite:M02449
biggM:M02449
sabiork.compound:18865
sabiorkM:18865
FJCUPROCOFFUSR-GMMZZHHDSA-N
Maltopentaose

biggM:M_M02449
secondary/obsolete/fantasy identifier