1beta-methylseleno-N-acetyl-D-galactosamine (Q4596716)

selenosugar B (English)

methyl 2-acetamido-1,2-dideoxy-1-seleno-beta-D-glucopyranoside

8 October 2016

stereoisomer of

1 reference

based on heuristic

inferred from InChI

chemical formula

C₉H₁₇NO₅Se

1 reference

selenosugar B (English)

8 October 2016

canonical SMILES

CC(=O)NC1C(C(C(OC1[Se]C)CO)O)O

1 reference

selenosugar B (English)

8 October 2016

isomeric SMILES

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

1 reference

https://reactome.org/PathwayBrowser/#/R-HSA-1430728&DTAB=MT

selenosugar B (English)

8 October 2016

1 reference

Commons category

1β-Methylseleno-N-acetyl-D-galactosamine

0 references

Identifiers

InChI

InChI=1S/C9H17NO5Se/c1-4(12)10-6-8(14)7(13)5(3-11)15-9(6)16-2/h5-9,11,13-14H,3H2,1-2H3,(H,10,12)/t5-,6-,7+,8-,9+/m1/s1

1 reference

selenosugar B (English)

AZZZNYGPGINRNT-ZEBDFXRSSA-N

8 October 2016

InChIKey

2 references

selenosugar B (English)

imported from Wikimedia project

8 October 2016

stated in

ChEBI release 2020-09-01

CAS Registry Number

526222-32-2

2 references

English Wikipedia

InChIKey

AZZZNYGPGINRNT-ZEBDFXRSSA-N

8 April 2021

https://commonchemistry.cas.org/detail?cas_rn=526222-32-2

1 reference

1β-Methylseleno-N-acetyl-D-galactosamine (English)

8 October 2016

1 reference

selenosugar B (English)

8 October 2016

ChEBI ID

77010

mapping relation type

2 references

1beta-methylseleno-N-acetyl-D-galactosamine (English)

matched by identifier from

8 October 2016

International Chemical Identifier

InChI

InChI=1S/C9H17NO5Se/c1-4(12)10-6-8(14)7(13)5(3-11)15-9(6)16-2/h5-9,11,13-14H,3H2,1-2H3,(H,10,12)/t5-,6-,7+,8-,9+/m1/s1

1 reference

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

DSSTOX compound identifier

DTXCID10419280

0 references

UNII

ZCQ8TN7ZMH

1 reference

matched by identifier from

InChIKey

AZZZNYGPGINRNT-ZEBDFXRSSA-N

1 reference

1beta-methylseleno-N-acetyl-D-galactosamine (English)