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beta-D-glucosaminyl-(1->4)-D-glucosamine

PropertiesImage
MNX_IDMNXM13289 Image of MNXM13289
referencechebi:50675
formulaC12H24N2O9
global charge0
mol weight340.329
InChIKeyQLTSDROPCWIKKY-ZMYKSUFESA-N
InChIInChI=1S/C12H24N2O9/c13-5-9(19)10(4(2-16)21-11(5)20)23-12-6(14)8(18)7(17)3(1-15)22-12/h3-12,15-20H,1-2,13-14H2/t3-,4-,5-,6-,7-,8-,9-,10-,11?,12+/m1/s1
SMILESN[C@H]1[C@H](O[C@H]2[C@H](O)[C@@H](N)C(O)O[C@@H]2CO)O[C@H](CO)[C@@H](O)[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C12H24N2O9/c13-5-9(19)10(4(2-16)21-11(5)20)23-12-6(14)8(18)7(17)3(1-15)22-12/h3-12,15-20H,1-2,13-14H2/t3-,4-,5-,6-,7-,8-,9-,10-,11?,12+/m1/s1 Image of MNXM13289
SMILES (mnx)[CH2:1]([C@@H:3]1[C@@H:7]([OH:17])[C@H:8]([OH:18])[C@@H:6]([NH2:14])[C@H:12]([O:23][C@@H:10]2[C@@H:4]([CH2:2][OH:16])[O:21][CH:11]([OH:20])[C@H:5]([NH2:13])[C@H:9]2[OH:19])[O:22]1)[OH:15]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:50675
chebi:50675
QLTSDROPCWIKKY-ZMYKSUFESA-N
beta-D-glucosaminyl-(1->4)-D-glucosamine
2-amino-4-O-(2-amino-2-deoxy-beta-D-glucopyranosyl)-2-deoxy-D-glucopyranose
WURCS=2.0/2,2,1/[a2122h-1x_1-5_2*N][a2122h-1b_1-5_2*N]/1-2/a4-b1

seed.compound:cpd23928
seedM:cpd23928
QLTSDROPCWIKKY-ZMYKSUFESA-P
2-amino-4-O-(2-amino-2-deoxy-beta-D-glucopyranosyl)-2-deoxy-beta-D-glucopyranose
CPD-13545
beta-D-glucosaminyl-(1->4)-beta-D-glucosamine

metacyc.compound:CPD-13545
metacycM:CPD-13545
QLTSDROPCWIKKY-ZMYKSUFESA-P
chitobiose
2-amino-4-O-(2-amino-2-deoxy-beta-D-glucopyranosyl)-2-deoxy-D-glucopyranose
beta-D-glucosaminyl-(1->4)-D-glucosamine

seedM:M_cpd23928
secondary/obsolete/fantasy identifier