Lophophorine hydrochloride
Basic information
- CAS
6112-95-4- Standard SMILES
COc1cc2c(c3c1OCO3)[C@H](C)N(C)CC2.Cl- InChIKey
KCIKWLFLJHFKRA-QRPNPIFTSA-N- Molecular formula
- C13H18ClNO3
- Average molar mass
- 271.74 g/mol
- Monoisotopic mass
- 271.0975211
Names & identifiers
- Preferred name
- Lophophorine hydrochloride
- IUPAC
- (9S)-4-methoxy-8,9-dimethyl-7,9-dihydro-6H-[1,3]dioxolo[4,5-h]isoquinoline;hydrochloride
Names & synonyms
Lophophorine hydrochloride6112-95-4Lophophorine hydrochloride [MI]UNII-4C03U1GHHSLophophorine, hydrochloride, (-)-4C03U1GHHS1,3-Dioxolo(4,5-H)isoquinoline, 6,7,8,9-tetrahydro-4-methoxy-8,9-dimethyl-, hydrochloride, (S)-(9S)-4-methoxy-8,9-dimethyl-7,9-dihydro-6H-[1,3]dioxolo[4,5-h]isoquinoline;hydrochlorideAKOS000277225Q27259388
Database identifiers
- CAS
6112-95-4- PubChem CID
- 16637635
- UNII
- 4C03U1GHHS
Properties
Computed structural properties
- Topological polar surface area
- 30.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 286
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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