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beta-D-GlcpNAc-(1->3)-[beta-D-GlcpNAc-(1->6)]-alpha-D-GalpNAc

PropertiesImage
MNX_IDMNXM103146 Image of MNXM103146
referencechebi:71341
formulaC24H41N3O16
global charge0
mol weight627.597
InChIKeyFFROIQJZYHNABU-RFRVBBKJSA-N
InChIInChI=1S/C24H41N3O16/c1-7(30)25-13-19(36)16(33)10(4-28)41-23(13)39-6-12-18(35)21(15(22(38)40-12)27-9(3)32)43-24-14(26-8(2)31)20(37)17(34)11(5-29)42-24/h10-24,28-29,33-38H,4-6H2,1-3H3,(H,25,30)(H,26,31)(H,27,32)/t10-,11-,12-,13-,14-,15-,16-,17-,18+,19-,20-,21-,22+,23-,24+/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[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)O[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C24H41N3O16/c1-7(30)25-13-19(36)16(33)10(4-28)41-23(13)39-6-12-18(35)21(15(22(38)40-12)27-9(3)32)43-24-14(26-8(2)31)20(37)17(34)11(5-29)42-24/h10-24,28-29,33-38H,4-6H2,1-3H3,(H,25,30)(H,26,31)(H,27,32)/t10-,11-,12-,13-,14-,15-,16-,17-,18+,19-,20-,21-,22+,23-,24+/m1/s1 Image of MNXM103146
SMILES (mnx)[CH3:1][C:7](=[N:25][C@@H:13]1[C@@H:19]([OH:36])[C@H:16]([OH:33])[C@@H:10]([CH2:4][OH:28])[O:41][C@H:23]1[O:39][CH2:6][C@@H:12]1[C@H:18]([OH:35])[C@H:21]([O:43][C@H:24]2[C@H:14]([N:26]=[C:8]([CH3:2])[OH:31])[C@@H:20]([OH:37])[C@H:17]([OH:34])[C@@H:11]([CH2:5][OH:29])[O:42]2)[C@@H:15]([N:27]=[C:9]([CH3:3])[OH:32])[C@@H:22]([OH:38])[O:40]1)[OH:30]
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:71341
chebi:71341
FFROIQJZYHNABU-RFRVBBKJSA-N 		beta-D-GlcpNAc-(1->3)-[beta-D-GlcpNAc-(1->6)]-alpha-D-GalpNAc
2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-[2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->6)]-2-acetamido-2-deoxy-alpha-D-galactopyranose
GlcNAcb1-3(GlcNAcb1-6)GalNAca
GlcNAcb1-6(GlcNAcb1-3)GalNAca
GlcNAcbeta1-3(GlcNAcbeta1-6)GalNAcalpha
GlcNAcbeta1-6(GlcNAcbeta1-3)GalNAcalpha
N-acetyl-beta-D-glucosaminyl-(1->3)-[N-acetyl-beta-D-glucosaminyl-(1->6)]-N-acetyl-alpha-D-galactosamine
O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1->3)-O-[2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1->6)]-2-(acetylamino)-2-deoxy-alpha-D-galactopyranose
WURCS=2.0/2,3,2/[a2112h-1a_1-5_2*NCC/3=O][a2122h-1b_1-5_2*NCC/3=O]/1-2-2/a3-b1_a6-c1
beta-D-GlcNAc-(1->3)-[beta-D-GlcNAc-(1->6)]-alpha-D-GalNAc

CHEBI:157305
chebi:157305
FFROIQJZYHNABU-VSZVPJMISA-N 		N-[(3R,4R,5S,6R)-2-[[(2R,3R,4R,5R,6S)-5-Acetamido-4-[(3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,6-dihydroxyoxan-2-yl]methoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
2-acetamido-2-deoxy-D-gluco-hexopyranosyl-(1->3)-[2-acetamido-2-deoxy-D-gluco-hexopyranosyl-(1->6)]-2-acetamido-2-deoxy-alpha-D-galacto-hexopyranose
GlcNAc(?1-3)[GlcNAc(?1-6)]a-GalNAc
WURCS=2.0/2,3,2/[a2112h-1a_1-5_2*NCC/3=O][a2122h-1x_1-5_2*NCC/3=O]/1-2-2/a3-b1_a6-c1