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alpha-maltohexaose

PropertiesImage
MNX_IDMNXM1093344 Image of MNXM1093344
referencechebi:61953
formulaC36H62O31
global charge0
mol weight990.861
InChIKeyOCIBBXPLUVYKCH-QXVNYKTNSA-N
InChIInChI=1S/C36H62O31/c37-1-7-13(43)14(44)21(51)32(58-7)64-27-9(3-39)60-34(23(53)16(27)46)66-29-11(5-41)62-36(25(55)18(29)48)67-30-12(6-42)61-35(24(54)19(30)49)65-28-10(4-40)59-33(22(52)17(28)47)63-26-8(2-38)57-31(56)20(50)15(26)45/h7-56H,1-6H2/t7-,8-,9-,10-,11-,12-,13-,14+,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31+,32-,33-,34-,35-,36-/m1/s1
SMILESOC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@@H](O[C@H]4[C@H](O)[C@@H](O)[C@@H](O[C@H]5[C@H](O)[C@@H](O)[C@@H](O[C@H]6[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]6CO)O[C@@H]5CO)O[C@@H]4CO)O[C@@H]3CO)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C36H62O31/c37-1-7-13(43)14(44)21(51)32(58-7)64-27-9(3-39)60-34(23(53)16(27)46)66-29-11(5-41)62-36(25(55)18(29)48)67-30-12(6-42)61-35(24(54)19(30)49)65-28-10(4-40)59-33(22(52)17(28)47)63-26-8(2-38)57-31(56)20(50)15(26)45/h7-56H,1-6H2/t7-,8-,9-,10-,11-,12-,13-,14+,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31+,32-,33-,34-,35-,36-/m1/s1 Image of MNXM1093344
SMILES (mnx)[CH2:1]([C@@H:7]1[C@@H:13]([OH:43])[C@H:14]([OH:44])[C@@H:21]([OH:51])[C@@H:32]([O:64][C@@H:27]2[C@@H:9]([CH2:3][OH:39])[O:60][C@H:34]([O:66][C@@H:29]3[C@@H:11]([CH2:5][OH:41])[O:62][C@H:36]([O:67][C@@H:30]4[C@@H:12]([CH2:6][OH:42])[O:61][C@H:35]([O:65][C@@H:28]5[C@@H:10]([CH2:4][OH:40])[O:59][C@H:33]([O:63][C@@H:26]6[C@@H:8]([CH2:2][OH:38])[O:57][C@H:31]([OH:56])[C@H:20]([OH:50])[C@H:15]6[OH:45])[C@H:22]([OH:52])[C@H:17]5[OH:47])[C@H:24]([OH:54])[C@H:19]4[OH:49])[C@H:25]([OH:55])[C@H:18]3[OH:48])[C@H:23]([OH:53])[C@H:16]2[OH:46])[O:58]1)[OH:37]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)31
in models (compartimentalized) 27
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:61953
chebi:61953
OCIBBXPLUVYKCH-QXVNYKTNSA-N 		alpha-maltohexaose
WURCS=2.0/1,6,5/[a2122h-1a_1-5]/1-1-1-1-1-1/a4-b1_b4-c1_c4-d1_d4-e1_e4-f1
alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp
alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranose

CHEBI:143182
chebi:143182
OCIBBXPLUVYKCH-LIGGPISVSA-N 		D-maltohexaose
Glc(a1-4)Glc(a1-4)Glc(a1-4)Glc(a1-4)Glc(a1-4)Glc
WURCS=2.0/2,6,5/[a2122h-1x_1-5][a2122h-1a_1-5]/1-2-2-2-2-2/a4-b1_b4-c1_c4-d1_d4-e1_e4-f1
alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-D-Glcp
alpha-D-gluco-hexopyranosyl-(1->4)-alpha-D-gluco-hexopyranosyl-(1->4)-alpha-D-gluco-hexopyranosyl-(1->4)-alpha-D-gluco-hexopyranosyl-(1->4)-alpha-D-gluco-hexopyranosyl-(1->4)-D-gluco-hexopyranose
alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-D-glucopyranose

bigg.metabolite:M02447
biggM:M02447
bigg.metabolite:malth
biggM:malth
bigg.metabolite:malthx
biggM:malthx
kegg.compound:C01936
keggC:C01936
kegg.glycan:G00755
keggG:G00755
OCIBBXPLUVYKCH-LIGGPISVSA-N
OCIBBXPLUVYKCH-QXVNYKTNSA-N 		Maltohexaose

vmhM:M02447
vmhmetabolite:M02447
vmhM:malthx
vmhmetabolite:malthx
OCIBBXPLUVYKCH-QXVNYKTNSA-N 		Maltohexaose
(2R,3R,4S,5S,6R)-2-{[(2R,3S,4R,5R,6R)-6-{[(2R,3S,4R,5R,6R)-6-{[(2R,3S,4R,5R,6R)-6-{[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-{[(2R,3S,4R,5R,6S)-4,5,6-trihydroxy-2-(hydroxym
hmdb:HMDB0012253
OCIBBXPLUVYKCH-QXVNYKTNSA-N 		Maltohexaose
(2R,3R,4S,5S,6R)-2-{[(2R,3S,4R,5R,6R)-6-{[(2R,3S,4R,5R,6R)-6-{[(2R,3S,4R,5R,6R)-6-{[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-{[(2R,3S,4R,5R,6S)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}oxan-3-yl]oxy}-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Maltohexanose DP6
WURCS=2.0/1,6,5/[a2122h-1a_1-5]/1-1-1-1-1-1/a4-b1_b4-c1_c4-D1_d4-e1_e4-F1
a-D-GLCP-(1->4)-a-D-GLCP-(1->4)-a-D-GLCP-(1->4)-a-D-GLCP-(1->4)-a-D-GLCP-(1->4)-a-D-GLCP
a-Maltohexaose
alpha-D-GLCP-(1->4)-alpha-D-GLCP-(1->4)-alpha-D-GLCP-(1->4)-alpha-D-GLCP-(1->4)-alpha-D-GLCP-(1->4)-alpha-D-GLCP
alpha-maltohexaose

seed.compound:cpd01329
seedM:cpd01329
OCIBBXPLUVYKCH-LIGGPISVSA-N 		Maltohexaose
malthx
maltohexaose

metacyc.compound:MALTOHEXAOSE
metacycM:MALTOHEXAOSE
OCIBBXPLUVYKCH-LIGGPISVSA-N 		maltohexaose

hmdb:HMDB12253
biggM:M_M02447
biggM:M_malth
biggM:M_malthx
keggC:M_C01936
keggG:M_G00755
seedM:M_cpd01329
vmhM:M_M02447
vmhM:M_malthx 		secondary/obsolete/fantasy identifier