Dauriporphine
Basic information
- CAS
88142-60-3- Standard SMILES
COc1ccc2c(c1)C(=O)c1c(OC)c(OC)c(OC)c3ccnc-2c13- InChIKey
OOWSNEKQIRVGCG-UHFFFAOYSA-N- Molecular formula
- C20H17NO5
- Average molar mass
- 351.4 g/mol
- Monoisotopic mass
- 351.11067264
Overview
Bianfugenine is an isoquinoline alkaloid that is dibenzo[de,h]quinolin-7-one carrying four methoxy substituents at positions 4, 5, 6 and 9. It has a role as an antineoplastic agent, a platelet aggregation inhibitor and a plant metabolite. It is an isoquinoline alkaloid, an aromatic ether, an organic heterotetracyclic compound, a cyclic ketone, a polyether and an aromatic ketone.
Names & identifiers
- Preferred name
- Dauriporphine
- IUPAC
- 5,10,11,12-tetramethoxy-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2(7),3,5,9,11,13(17),14-octaen-8-one
- English name
- bianfugenine
- Molecular formula
- C20H17NO5
- Molecular weight
- 351.35
Names & synonyms
DauriporphineBianfugenine88142-60-34,5,6,9-tetramethoxy-7H-dibenzo[de,h]quinolin-7-one4,5,6,9-Tetramethoxy-7H-dibenzo(de,h)quinolin-7-one5,10,11,12-tetramethoxy-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2(7),3,5,9,11,13(17),14-octaen-8-oneCHEBI:132719DTXSID902368515,10,11,12-tetramethoxy-16-azatetracyclo(7.7.1.02,7.013,17)heptadeca-1(16),2(7),3,5,9,11,13(17),14-octaen-8-oneRefChem:119619DTXCID201593427H-Dibenzo[de,h]quinolin-7-one, 4,5,6,9-tetramethoxy-
Show more names
7H-Dibenzo(de,h)quinolin-7-one, 4,5,6,9-tetramethoxy-orb1992558CHEMBL4214251SCHEMBL12289184HY-N11029MFCD35070625AKOS040734156DA-61659
Database identifiers
- CAS
88142-60-3- PubChem CID
- 137399
- DTXSID
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 66.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 528
Chemistry & industry
Applications
UsesDauriporphine, an alkaloid, can be isolated from the vines of Menispermum dauricum DC[1].
Additional notes
DefinitionChEBI: Bianfugenine is an isoquinoline alkaloid that is dibenzo[de,h]quinolin-7-one carrying four methoxy substituents at positions 4, 5, 6 and 9. It has a role as a plant metabolite, a platelet aggregation inhibitor and an antineoplastic agent. It is an isoquinoline alkaloid, a polyether, an aromatic ether, a cyclic ketone, an aromatic ketone and an organic heterotetracyclic compound.
Related reactions
0 records
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Compound notes
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