Back

Chemistry

Mol. Mass

303.3529

ALogP

0.92

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CN1[C@H]2C[C@@H](C[C@@H]1[C@H]3O[C@@H]23)OC(=O)[C@H](CO)C4=CC=CC=C4
  • InChIKey: STECJAGHUSJQJN-FWXGHANASA-N
    1S/C17H21NO4/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10/h2-6,11-16,19H,7-9H2,1H3/t11-,12-,13-,14+,15-,16+/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1187846   ChEMBL
scopolamine

CHEMBL1256744   ChEMBL
scopolamine hydrobromide

CHEMBL1256901   ChEMBL
butylscopolamine bromide

CHEMBL1618102   ChEMBL
butylscopolamine

CHEMBL3138621   ChEMBL
scopolamine hydrobromide

CHEMBL3833334   ChEMBL
papaveretum

CHEMBL569713   ChEMBL
scopolamine

DL48G20X8X   NCATS
scopolamine *

Scopolamine   Wikipedia

Hyoscine butylbromide   Wikipedia

Feedback

Data collection and curation is an ongoing process for CDEK - if you notice any information here to be missing or incorrect, please let us know! When possible, please include a source URL (we verify all data prior to inclusion).

Report issue