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Basic information
- CAS
476-33-5- Standard SMILES
COc1ccc2c(c1OC)CN(C)[C@@H]1c3cc4c(cc3C[C@H](O)[C@H]21)OCO4- InChIKey
MADYLZJCRKUBIK-RYGJVYDSSA-N- Molecular formula
- C21H23NO5
- Average molar mass
- 369.417 g/mol
- Monoisotopic mass
- 369.15762284
Names & identifiers
- Preferred name
- Homochelidonine
- IUPAC
- (4bR,5S,11bS)-1,2-Dimethoxy-12-methyl-4b,5,6,11b,12,13-hexahydro-9H-[1,3]benzodioxolo[5,6-c]phenanthridin-5-ol
- English name
- A-ALLOCRYPTOPINE
- Molecular formula
- C21H23NO5
- Molecular weight
- 369.41
Names & synonyms
HOMOCHELIDONINEA-ALLOCRYPTOPINEα-HomochelidonineA-HOMOCHELIDONINEHOMOCHELIDONINE, A-ALPHA-HOMOCHELIDONINEHOMOCHELIDONINE, a-(P)Sibutramine Impurity 11(4bR)-4b,5,6,11bα,12,13-Hexahydro-1,2-dimethoxy-12-methyl[1,3]benzodioxolo[5,6-c]phenanthridin-5β-ol(4bR,5S,11bS)-1,2-dimethoxy-12-methyl-5,6,11b,13-tetrahydro-4bH-[1,3]benzodioxolo[5,6-c]phenanthridin-5-ol
Database identifiers
- CAS
476-33-5- PubChem CID
- 164609
- DTXSID
DTXSID20197209- ChEMBL
CHEMBL5273689- ChEBI
CHEBI:31025- UNII
- ZP901RX893
- EC Number
- 207-505-7
- Nikkaji
- J5.975G
Properties
Physicochemical properties
- Melting point
- 182 ° · 182°
- alpha
- 118 ° · D +118° (alc)
- Boiling point
- 521.3 · 521.3±50.0 °C(Predicted)
- Density
- 1.294 · 1.294±0.06 g/cm3(Predicted)
- pka
- 14.11 · 14.11±0.20(Predicted)
- FDA UNII
- 901 RX893 · ZP901RX893
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
UsesHomochelidonine is pharmaceutical compound comprising alkaloids and non-alkaloid components.
Suppliers3 total
成都标样生物科技有限公司028-81700200 13308200041 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
上海甄准生物科技有限公司18019219489 18901678489 · [email protected]
Additional notes
DefinitionChEBI: (+/-)-Homochelidonine is a benzophenanthridine alkaloid.
Related reactions
0 records
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Compound notes
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