Basic information
- CAS
40360-71-2- Standard SMILES
O=c1c2cc3c(cc2c2cccc4c2n1CC4)OCO3- InChIKey
UJOHABFHKQHIKS-UHFFFAOYSA-N- Molecular formula
- C16H11NO3
- Average molar mass
- 265.26 g/mol
- Monoisotopic mass
- 265.07389321
Overview
Anhydrolycorinone is a member of phenanthridines.
Names & identifiers
- Preferred name
- Anhydrolycorinone
- IUPAC
- 5,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.015,19]nonadeca-1(18),2,4(8),9,15(19),16-hexaen-11-one
- English name
- anhydrolycorinone
- Molecular formula
- C16H11NO3
- Molecular weight
- 265.26
Names & synonyms
Anhydrolycorinone40360-71-2anhydroly-corinoneDTXSID403137675,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.015,19]nonadeca-1(18),2,4(8),9,15(19),16-hexaen-11-one(5R,5aR,8aR)-5-(3,4-dimethoxyphenyl)-5a,8,8a,9-tetrahydro-5H-isobenzofuro(5,6-f)(1,3)benzodioxol-6-one(5R,5aR,8aR)-5-(3,4-dimethoxyphenyl)-5a,8,8a,9-tetrahydro-5H-isobenzofuro[5,6-f][1,3]benzodioxol-6-one5,7-dioxa-12-azapentacyclo(10.6.1.02,10.04,8.015,19)nonadeca-1(18),2,4(8),9,15(19),16-hexaen-11-oneRefChem:915877DTXCID90264891CHEMBL481446NSC276737
Show more names
AnhydrolycorinonAnhydrolycorin-7-one4,5-Dihydro-7H-[1,3]dioxolo[4,5-j]pyrrolo[3,2,1-de]phenanthridine-7-one7H-[1,3]Dioxolo[4,5-j]pyrrolo[3,2,1-de]phenanthridin-7-one, 4,5-dihydro-9,10-(Methylenedioxy)-4,5-dihydro-7H-pyrrolo[3,2,1-de]phenanthridine-7-one
NSC-276737C12250C16H11NO3AC1L85AZCHEBI:31222Q271142264,5-Dihydro-7H,10H-[1,3]dioxolo[4,5-j]pyrrolo[3,2,1-de]phenanthridin-7-one
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 439
Experimental & physicochemical properties
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Physicochemical properties
- Melting point
- 246 · 246-247 °C(Solv: ethanol (64-17-5))
- Boiling point
- 524.8 · 524.8±50.0 °C(Predicted)
- Density
- 1.53 · 1.53±0.1 g/cm3(Predicted)
- pka
- -1.63 · -1.63±0.20(Predicted)
Chemistry & industry
Additional notes
DefinitionChEBI: Anhydrolycorinone is a member of phenanthridines.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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