scopolamineImported
A tropane alkaloid that is the (S)-tropic acid ester of 6beta,7beta-epoxy-1alphaH,5alphaH-tropan-3alpha-ol.
Defined bychebi
Exact Synonyms
(1R,2R,4S,5S,7S)-9-methyl-3-oxa-9-azatricyclo[3.3.1.0(2,4)]non-7-yl (2S)-3-hydroxy-2-phenylpropanoate
scopolamine
Scopolamine
Related Synonyms
(-)-Hyoscine
(-)-hyoscine
(-)-scopolamine
(1S,3S,5R,6R,7S)-6,7-epoxytropan-3-yl (2S)-3-hydroxy-2-phenylpropanoate
6,7-Epoxytropine tropate
6-beta,7-beta-Epoxy-3-alpha-tropanyl S-(-)-tropate
alpha-(Hydroxymethyl)benzeneacetic acid 9-methyl-3-oxa-9-azatricyclo(3.3.1.0(2.4))non-7-yl ester
Hyoscine
scopine (-)-tropate
Transderm-Scop
class Information
charge
0
formula
C17H21NO4
has_alternative_id
has_dbxref
has_obo_namespace
chebi_ontology
inchi
InChI=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
inchikey
STECJAGHUSJQJN-FWXGHANASA-N
in_subset
mass
303.35290
monoisotopicmass
303.14706
smiles
CN1[C@H]2C[C@@H](C[C@@H]1[C@H]1O[C@@H]21)OC(=O)[C@H](CO)c1ccccc1
class Relations
Subclass of
- epoxidechebi
- propanoate esterchebi
- tropane alkaloidchebi
- tertiary amino compoundchebi
- has rolerosomemetabolitechebi
- has rolerosomeantidepressantchebi
- has rolerosomemuscarinic antagonistchebi
- has rolerosomemydriatic agentchebi
- has rolerosomeantiemeticchebi
- has rolerosomeantispasmodic drugchebi
- has rolerosomeanaesthesia adjuvantchebi
- has rolerosomeadjuvantchebi
- has functional parentsome(S)-tropic acidchebi
- is conjugate base ofsomescopolamine(1+)chebi
Related from
is conjugate acid of
has functional parent