S-(+)-Apomorphine
Basic information
- CAS
39478-62-1- Standard SMILES
CN1CCc2cccc3c2[C@@H]1Cc1ccc(O)c(O)c1-3- InChIKey
VMWNQDUVQKEIOC-ZDUSSCGKSA-N- Molecular formula
- C17H17NO2
- Average molar mass
- 267.32 g/mol
- Monoisotopic mass
- 267.12592879
Names & identifiers
- Preferred name
- S-(+)-Apomorphine
- IUPAC
- (6aS)-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-10,11-diol
Names & synonyms
S-(+)-apomorphineS(+)-APOMORPHINE(6aS)-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-10,11-diol(6aS)-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo(de,g)quinoline-10,11-diolRefChem:1098203S-apomorphine39478-62-1Apomorphine, S-LH812IV7LI(+)-10,11-DihydroxyaporphineUNII-LH812IV7LI4H-Dibenzo(de,g)quinoline-10,11-diol, 5,6,6a,7-tetrahydro-6-methyl-, (S)-
Show more names
CHEMBL416288(+)-Apomorphine(S)APOMORPHINELopac-A-4393S(+)-10,11-DIHYDROXYAPORPHINE HYDROCHLORIDE(S)-ApomorphineApomorphine,(+)APOMORPHINE, (S)-
Database identifiers
- CAS
39478-62-1- PubChem CID
- 736083
- DTXSID
DTXSID40192615- ChEMBL
CHEMBL416288- UNII
- LH812IV7LI
- Nikkaji
- J322.345K
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 43.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 374
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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