U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C31H53NO23
Molecular Weight 807.7454
Optical Activity UNSPECIFIED
Defined Stereocenters 22 / 22
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of O-4,6-DIDEOXY-4-(((1S,4R,5S,6S)-4,5,6-TRIHYDROXY-3-(HYDROXYMETHYL)-2-CYCLOHEXEN-1-YL)AMINO)-.ALPHA.-D-GLUCOPYRANOSYL-(1->4)-O-.ALPHA.-D-GLUCOPYRANOSYL-(1->4)-O-.ALPHA.-D-GLUCOPYRANOSYL-(1->4)-D-FRUCTOSE

SMILES

[H][C@]4(N[C@@H]1[C@@H](C)O[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]([C@H](O)CO)[C@H](O)C(=O)CO)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)C=C(CO)[C@@H](O)[C@H](O)[C@H]4O

InChI

InChIKey=MEPXIUXMJVDQJW-AXJUGWJOSA-N
InChI=1S/C31H53NO23/c1-8-15(32-10-2-9(3-33)16(40)20(44)17(10)41)19(43)23(47)29(50-8)54-27-13(6-36)52-31(25(49)22(27)46)55-28-14(7-37)51-30(24(48)21(28)45)53-26(12(39)5-35)18(42)11(38)4-34/h2,8,10,12-37,39-49H,3-7H2,1H3/t8-,10+,12-,13-,14-,15-,16-,17+,18-,19+,20+,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
O-4,6-DIDEOXY-4-(((1S,4R,5S,6S)-4,5,6-TRIHYDROXY-3-(HYDROXYMETHYL)-2-CYCLOHEXEN-1-YL)AMINO)-.ALPHA.-D-GLUCOPYRANOSYL-(1->4)-O-.ALPHA.-D-GLUCOPYRANOSYL-(1->4)-O-.ALPHA.-D-GLUCOPYRANOSYL-(1->4)-D-FRUCTOSE
Systematic Name English
ACARBOSE IMPURITY E
Common Name English
ACARBOSE IMPURITY E [USP IMPURITY]
Common Name English
O-4,6-DIDEOXY-4-(((1S,4R,5S,6S)-4,5,6-TRIHYDROXY-3-(HYDROXYMETHYL)CYCLOHEX-2-ENYL)AMINO)-.ALPHA.-D-GLUCOPYRANOSYL-(1->4)-O-.ALPHA.-D-GLUCOPYRANOSYL-(1->4)-O-.ALPHA.-D-GLUCOPYRANOSYL-(1->4)-D-ARABINO-HEX-2-ULOPYRANOSE (4-O-.ALPHA.-ACARBOSYL-D-FRUCTOPYRANO
Systematic Name English
ACARBOSE IMPURITY E [EP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
131869440
Created by admin on Sat Dec 16 14:48:11 GMT 2023 , Edited by admin on Sat Dec 16 14:48:11 GMT 2023
PRIMARY
FDA UNII
R59T36P3BA
Created by admin on Sat Dec 16 14:48:11 GMT 2023 , Edited by admin on Sat Dec 16 14:48:11 GMT 2023
PRIMARY
CAS
1220983-28-7
Created by admin on Sat Dec 16 14:48:11 GMT 2023 , Edited by admin on Sat Dec 16 14:48:11 GMT 2023
PRIMARY