(Q27132974)

(GlcA)1 (GlcNAc)1 (English)

7 October 2016

chemical formula

C₁₄H₂₃NO₁₂

1 reference

(GlcA)1 (GlcNAc)1 (English)

7 October 2016

canonical SMILES

CC(=O)NC1C(C(C(OC1O)CO)O)OC2C(C(C(C(O2)C(=O)O)O)O)O

1 reference

(GlcA)1 (GlcNAc)1 (English)

7 October 2016

isomeric SMILES

CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](OC1O)CO)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O

1 reference

(GlcA)1 (GlcNAc)1 (English)

InChI=1S/C14H23NO12/c1-3(17)15-5-10(6(18)4(2-16)25-13(5)24)26-14-9(21)7(19)8(20)11(27-14)12(22)23/h4-11,13-14,16,18-21,24H,2H2,1H3,(H,15,17)(H,22,23)/t4-,5-,6-,7+,8+,9-,10-,11+,13?,14-/m1/s1

7 October 2016

Identifiers

InChI

1 reference

(GlcA)1 (GlcNAc)1 (English)

LJORHONFMDUUHP-ASXIHULMSA-N

7 October 2016

InChIKey

2 references

(GlcA)1 (GlcNAc)1 (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

beta-D-GlcpA-(1->3)-D-GlcpNAc (English)

7 October 2016

1 reference

beta-D-GlcpA-(1->3)-D-GlcpNAc (English)

7 October 2016

1 reference

(GlcA)1 (GlcNAc)1 (English)

7 October 2016

ChEBI ID

64024

mapping relation type

1 reference

DSSTOX compound identifier

beta-D-GlcpA-(1->3)-D-GlcpNAc (English)

7 October 2016

1 reference

0 references

DTXCID701342674

0 references

EC number

307-780-4

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.097.936

27 December 2018

ECHA Substance Infocard ID

2-acetamido-2-deoxy-3-O-β-D-glucopyranuronosyl-β-D-glucopyranose (English)

quotation

CAS no.: 97747-46-1 (English)

100.097.936

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.097.936

27 December 2018