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

Details

Stereochemistry ABSOLUTE
Molecular Formula C24H25NO5
Molecular Weight 407.459
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZOYLSCOPOLAMINE

SMILES

[H][C@@]12O[C@]1([H])[C@H]3C[C@H](C[C@@H]2N3C)OC(=O)[C@H](COC(=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChIKey=PYIZRLUJDRRXLD-JOLMYRCBSA-N
InChI=1S/C24H25NO5/c1-25-19-12-17(13-20(25)22-21(19)30-22)29-24(27)18(15-8-4-2-5-9-15)14-28-23(26)16-10-6-3-7-11-16/h2-11,17-22H,12-14H2,1H3/t17-,18-,19-,20+,21-,22+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
BENZOYLSCOPOLAMINE
Common Name English
SCOPOLAMINE BENZOATE
Common Name English
HYOSCINE BENZOATE
Common Name English
BENZENEACETIC ACID, .ALPHA.-((BENZOYLOXY)METHYL)-, 9-METHYL-3-OXA-9-AZATRICYCLO(3.3.1.02,4)NON-7-YL ESTER, (7(S)-(1.ALPHA.,2.BETA.,4.BETA.,5.ALPHA.,7.BETA.))-
Systematic Name English
Code System Code Type Description
PUBCHEM
31082
Created by admin on Sat Dec 16 08:46:49 GMT 2023 , Edited by admin on Sat Dec 16 08:46:49 GMT 2023
PRIMARY
CAS
1927-18-0
Created by admin on Sat Dec 16 08:46:49 GMT 2023 , Edited by admin on Sat Dec 16 08:46:49 GMT 2023
PRIMARY
EPA CompTox
DTXSID00940937
Created by admin on Sat Dec 16 08:46:49 GMT 2023 , Edited by admin on Sat Dec 16 08:46:49 GMT 2023
PRIMARY
FDA UNII
0YX0C8Y60J
Created by admin on Sat Dec 16 08:46:49 GMT 2023 , Edited by admin on Sat Dec 16 08:46:49 GMT 2023
PRIMARY