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acarbose (CHEBI:2376)

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ChEBI Name acarbose
ChEBI ID CHEBI:2376
Last Modified 17 October 2009
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:520634
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InChI
InChI=1/C25H43NO18/c1-6-11(26-8-2-7(3-27)12(30)15(33)13(8)31)14(32)19(37)24(40-6)43-22-10(5-29)42-25(20(38)17(22)35)44-21-9(4-28)41-23(39)18(36)16(21)34/h2,6,8-39H,3-5H2,1H3/t6-,8+,9-,10-,11-,12+,13+,14+,15+,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-/m1/s1
InChIKey
InChIKey=XUFXOAAUWZOOIT-JMPDRRIHBD
SMILES
C[C@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@H](O[C@@H]3[C@@H](CO)O[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1N[C@H]1C=C(CO)[C@H](O)[C@H](O)[C@H]1O
Formula Source
C25H43NO18 KEGG COMPOUND
Charge 0
Mass 645.60486
ChEBI Ontology
Tree view
Outgoing acarbose (CHEBI:2376) is a tetrasaccharide (CHEBI:50126)
acarbose (CHEBI:2376) has role alpha-glucoside hydrolase inhibitor (CHEBI:50628)
acarbose (CHEBI:2376) has role alpha-amylase inhibitor (CHEBI:50627)
IUPAC Name
4,6-dideoxy-4-{[(1S,4S,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}-α-D-glucopyranosyl-(1→4)-α-D-glucopyranosyl-(1→4)-D-glucose
INNs Sources
acarbosa ChemIDplus
acarbose ChEBI
acarbosum ChemIDplus
Synonyms Sources
Acarbose KEGG COMPOUND
Precose ChemIDplus
Brand Names Sources
Glucobay DrugBank
Precose DrugBank
Database Links Databases
C06802 KEGG COMPOUND
D00216 KEGG DRUG
DB00284 DrugBank
DE2347782 Patent
US4062950 Patent
520634 ChEMBL
Registry Numbers Types Sources
56180-94-0 CAS Registry Number KEGG COMPOUND
56180-94-0 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
18020421 PubMed citation ChEMBL
18194870 PubMed citation ChEMBL

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