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alpha-D-GlcNAc6S-(1->4)-D-GlcA

Properties

Image

Occurences in reactions

MNX_ID

MNXM102521

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₁₄H₂₃NO₁₅S

charge

mass

477.07884

reference

chebi:65142

InChIKey

NQEVMSRGYQJUGR-QKJYSWECSA-N

InChI

InChI=1S/C14H23NO15S/c1-3(16)15-5-7(18)6(17)4(2-27-31(24,25)26)28-14(5)30-10-8(19)9(20)13(23)29-11(10)12(21)22/h4-11,13-14,17-20,23H,2H2,1H3,(H,15,16)(H,21,22)(H,24,25,26)/t4-,5-,6-,7-,8-,9-,10+,11+,13?,14-/m1/s1

SMILES

CC(=O)N[C@H]1[C@@H](O[C@@H]2[C@@H](C(=O)O)OC(O)[C@H](O)[C@H]2O)O[C@H](COS(=O)(=O)O)[C@@H](O)[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:65142 chebi:65142	alpha-D-GlcNAc6S-(1->4)-D-GlcA (GlcA)1 (GlcNAc)1 (S)1 2-acetamido-2-deoxy-6-O-sulfo-alpha-D-glucopyranosyl-(1->4)-D-glucopyranuronic acid 4-O-(2-acetamido-2-deoxy-6-O-sulfo-alpha-D-glucopyranosyl)-D-glucopyranuronic acid 6-O-sulfo-N-acetyl-alpha-D-glucosaminyl-(1->4)-D-glucuronic acid alpha-D-GlcpNAc6S-(1->4)-D-GlcpA
seed.compound:cpd21663 seedM:cpd21663	(GlcA)1(GlcNAc)1(S)1
seedM:M_cpd21663	secondary/obsolete/fantasy identifier