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

Details

Stereochemistry ABSOLUTE
Molecular Formula C25H42N4O14
Molecular Weight 622.6194
Optical Activity ( - )
Defined Stereocenters 15 / 15
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALLOSAMIDIN

SMILES

[H][C@@]12OC(=N[C@]1([H])[C@@H](O)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]4NC(C)=O)[C@@H](O)[C@H]3NC(C)=O)[C@H]2CO)N(C)C

InChI

InChIKey=MDWNFWDBQGOKNZ-XYUDZHFQSA-N
InChI=1S/C25H42N4O14/c1-8(33)26-14-17(36)16(35)11(6-31)39-23(14)42-22-12(7-32)40-24(15(19(22)38)27-9(2)34)41-21-10(5-30)20-13(18(21)37)28-25(43-20)29(3)4/h10-24,30-32,35-38H,5-7H2,1-4H3,(H,26,33)(H,27,34)/t10-,11+,12+,13+,14+,15+,16+,17-,18+,19-,20-,21+,22+,23-,24-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
ALLOSAMIDIN
Common Name English
(-)-ALLOSAMIDINE
Common Name English
.BETA.-D-ALLOPYRANOSIDE, (3AR,4R,5R,6S,6AS)-2-(DIMETHYLAMINO)-3A,5,6,6A-TETRAHYDRO-4-HYDROXY-6-(HYDROXYMETHYL)-4H-CYCLOPENTOXAZOL-5-YL 2-(ACETYLAMINO)-4-O-(2-(ACETYLAMINO)-2-DEOXY-.BETA.-D-ALLOPYRANOSYL)-2-DEOXY-
Systematic Name English
(3AR,4R,5R,6S,6AS)-2-(DIMETHYLAMINO)-3A,5,6,6A-TETRAHYDRO-4-HYDROXY-6-(HYDROXYMETHYL)-4H-CYCLOPENTOXAZOL-5-YL 2-(ACETYLAMINO)-4-O-(2-(ACETYLAMINO)-2-DEOXY-.BETA.-D-ALLOPYRANOSYL)-2-DEOXY-.BETA.-D-ALLOPYRANOSIDE
Systematic Name English
ALLOSAMIDIN [ISO]
Common Name English
(-)-ALLOSAMIDIN
Common Name English
Code System Code Type Description
PUBCHEM
119339
Created by admin on Sat Dec 16 09:37:46 GMT 2023 , Edited by admin on Sat Dec 16 09:37:46 GMT 2023
PRIMARY
FDA UNII
5UDJ46528K
Created by admin on Sat Dec 16 09:37:46 GMT 2023 , Edited by admin on Sat Dec 16 09:37:46 GMT 2023
PRIMARY
DRUG BANK
DB04628
Created by admin on Sat Dec 16 09:37:46 GMT 2023 , Edited by admin on Sat Dec 16 09:37:46 GMT 2023
PRIMARY
CAS
103782-08-7
Created by admin on Sat Dec 16 09:37:46 GMT 2023 , Edited by admin on Sat Dec 16 09:37:46 GMT 2023
PRIMARY
ALANWOOD
allosamidin
Created by admin on Sat Dec 16 09:37:46 GMT 2023 , Edited by admin on Sat Dec 16 09:37:46 GMT 2023
PRIMARY
EPA CompTox
DTXSID90883122
Created by admin on Sat Dec 16 09:37:46 GMT 2023 , Edited by admin on Sat Dec 16 09:37:46 GMT 2023
PRIMARY