METHYLHOMATROPINE

/static/temp/default.svg Search structure
Synonyms
Status
Molecule Category Free-form
UNII P97OGJ7L1L
EPA CompTox DTXSID10858832

Structure

InChI Key WKWOJBUWWZTUQV-SPUOUPEWSA-N
Smiles C[N+]1(C)[C@@H]2CC[C@H]1C[C@@H](OC(=O)C(O)c1ccccc1)C2
InChI
InChI=1S/C17H24NO3/c1-18(2)13-8-9-14(18)11-15(10-13)21-17(20)16(19)12-6-4-3-5-7-12/h3-7,13-16,19H,8-11H2,1-2H3/q+1/t13-,14+,15+,16?

Physicochemical Descriptors

Property Name Value
Molecular Formula C17H24NO3+
Molecular Weight 290.38
AlogP 2.03
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 3.0
Polar Surface Area 46.53
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 21.0

Related Entries

Cross References

Resources Reference
ChEMBL CHEMBL1201235
DrugCentral 1380
FDA SRS P97OGJ7L1L
PubChem 5282592
SureChEMBL SCHEMBL16784195
CONTENTS