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3-(4-deoxy-beta-D-gluc-4-enuronosyl)-N-acetyl-D-glucosamine

MNXM3926 is deprecated and here replaced by MNXM1106091
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM1106091

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	0

formula

C₁₄H₂₀NO₁₁

charge

-1

mass

378.10418

reference

chebi:132151

InChIKey

DLGJWSVWTWEWBJ-ZDLRKIOHSA-M

InChI

InChI=1S/C14H21NO11/c1-4(17)15-8-11(10(20)7(3-16)24-13(8)23)26-14-9(19)5(18)2-6(25-14)12(21)22/h2,5,7-11,13-14,16,18-20,23H,3H2,1H3,(H,15,17)(H,21,22)/p-1/t5-,7+,8+,9+,10+,11+,13?,14-/m0/s1

SMILES

CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O[C@@H]1OC(C(=O)[O-])=C[C@H](O)[C@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:132151 chebi:132151	3-(4-deoxy-beta-D-gluc-4-enuronosyl)-N-acetyl-D-glucosamine 2-acetamido-2-deoxy-3-O-(4-deoxy-alpha-L-threo-hex-4-enopyranuronosyl)-D-glucopyranose 3-(4-deoxy-beta-D-gluc-4-enuronosyl)-N-acetyl-D-glucosamine(1-) 4-deoxy-beta-D-gluc-4-enuronosyl-(1->3)-N-acetyl-D-glucosamine beta-D-4-deoxy-Delta(4)-GlcA-(1->3)-D-GlcNAc(1-) beta-D-4-deoxy-Delta(4)-GlcpA-(1->3)-D-GlcpNAc(1-)
seed.compound:cpd02913 seedM:cpd02913	3-(4-Deoxy-beta-D-gluc-4-enuronosyl)-N-acetyl-D-glucosamine 3-(4-Deoxy-alpha-L-threo-hex-4-enopyranosyluronic acid)-2-acetamido-2-deoxy-D-glucose 3-(4-deoxy-alpha-L-threo-hex-4-enopyranosyluronic acid)-2-acetamido-2-deoxy-D-glucose 3-(4-deoxy-beta-D-gluc-4-enuronosyl)-N-acetyl-D-glucosamine 4-deoxy-beta-D-gluc-4-enuronosyl-(1,3)-N-acetyl-D-glucosamine beta-D-4-deoxy-delta4-GlcAp-(1->3)-beta-D-GlcNAc
metacyc.compound:CPD-13473 metacycM:CPD-13473	3-(4-deoxy-beta-D-gluc-4-enuronosyl)-N-acetyl-D-glucosamine 3-(4-deoxy-alpha-L-threo-hex-4-enopyranosyluronic acid)-2-acetamido-2-deoxy-D-glucose 4-deoxy-beta-D-gluc-4-enuronosyl-(1,3)-N-acetyl-D-glucosamine beta-D-4-deoxy-Delta4-GlcAp-(1->3)-beta-D-GlcNAc
CHEBI:132805 chebi:132805	beta-D-4-deoxy-Delta(4)-GlcpA-(1->3)-D-GlcpNAc 3-(4-deoxy-beta-D-gluc-4-enuronosyl)-N-acetyl-D-glucosamine 4-deoxy-beta-D-gluc-4-enuronosyl-(1->3)-N-acetyl-D-glucosamine beta-D-4-deoxy-Delta(4)-GlcA-(1->3)-D-GlcNAc
seedM:M_cpd02913	secondary/obsolete/fantasy identifier