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beta-D-GalpNAc-(1->3)-alpha-D-GalpNAc

PropertiesImage
MNX_IDMNXM103131 Image of MNXM103131
referencechebi:68439
formulaC16H28N2O11
global charge0
mol weight424.403
InChIKeyFJGXDMQHNYEUHI-RWUFDMEESA-N
InChIInChI=1S/C16H28N2O11/c1-5(21)17-9-13(25)11(23)7(3-19)28-16(9)29-14-10(18-6(2)22)15(26)27-8(4-20)12(14)24/h7-16,19-20,23-26H,3-4H2,1-2H3,(H,17,21)(H,18,22)/t7-,8-,9-,10-,11+,12+,13-,14-,15+,16+/m1/s1
SMILESCC(=O)N[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2NC(C)=O)[C@@H](O)[C@@H](CO)O[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C16H28N2O11/c1-5(21)17-9-13(25)11(23)7(3-19)28-16(9)29-14-10(18-6(2)22)15(26)27-8(4-20)12(14)24/h7-16,19-20,23-26H,3-4H2,1-2H3,(H,17,21)(H,18,22)/t7-,8-,9-,10-,11+,12+,13-,14-,15+,16+/m1/s1 Image of MNXM103131
SMILES (mnx)[CH3:1][C:5](=[N:17][C@@H:9]1[C@@H:13]([OH:25])[C@@H:11]([OH:23])[C@@H:7]([CH2:3][OH:19])[O:28][C@H:16]1[O:29][C@@H:14]1[C@@H:10]([N:18]=[C:6]([CH3:2])[OH:22])[C@@H:15]([OH:26])[O:27][C@H:8]([CH2:4][OH:20])[C@@H:12]1[OH:24])[OH:21]
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:68439
chebi:68439
FJGXDMQHNYEUHI-RWUFDMEESA-N 		beta-D-GalpNAc-(1->3)-alpha-D-GalpNAc
2-(acetylamino)-3-O-[2-(acetylamino)-2-deoxy-beta-D-galactopyranosyl]-2-deoxy-alpha-D-galactopyranose
2-acetamido-3-O-(2-acetamido-2-deoxy-beta-D-galactopyranosyl)-2-deoxy-alpha-D-galactopyranose
GalNAcb1-3GalNAca
GalNAcbeta1-3GalNAcalpha
N-acetyl-beta-D-galactosaminyl-(1->3)-N-acetyl-alpha-D-galactosamine
WURCS=2.0/2,2,1/[a2112h-1a_1-5_2*NCC/3=O][a2112h-1b_1-5_2*NCC/3=O]/1-2/a3-b1
alpha-D-galactopyranose, 2-(acetylamino)-3-O-[2-(acetylamino)-2-deoxy-beta-D-galactopyranosyl]-2-deoxy-
beta-D-2-acetamido-2-deoxy-galactopyranosyl-(1->3)-alpha-D-2-acetamido-2-deoxy-galactopyranose