1,3,5-Trihydroxy-4-methoxy-10-methyl-2,8-bis(3-methylbut-2-enyl)acridin-9(10h)-one
Basic information
- CAS
935521-55-4- Standard SMILES
COc1c(O)c(CC=C(C)C)c(O)c2c(=O)c3c(CC=C(C)C)ccc(O)c3n(C)c12- InChIKey
LICNIJQEAUQKSD-UHFFFAOYSA-N- Molecular formula
- C25H29NO5
- Average molar mass
- 423.5 g/mol
- Monoisotopic mass
- 423.20457303
Overview
1,3,5-Trihydroxy-4-methoxy-10-methyl-2,8-bis(3-methylbut-2-enyl)acridin-9(10h)-one has been reported in Swinglea glutinosa with data available.
Names & identifiers
- Preferred name
- 1,3,5-Trihydroxy-4-methoxy-10-methyl-2,8-bis(3-methylbut-2-enyl)acridin-9(10h)-one
- IUPAC
- 1,3,5-trihydroxy-4-methoxy-10-methyl-2,8-bis(3-methylbut-2-enyl)acridin-9-one
Names & synonyms
CHEMBL1668597DTXSID601344358BDBM503364771,3,5-trihydroxy-4-methoxy-10-methyl-2,8-bis(3-methylbut-2-enyl)acridin-9(10h)-one935521-55-41,3,5-Trihydroxy-4-methoxy-10-methyl-2,8-bis(3-methyl-2-buten-1-yl)-9(10H)-acridinone
Database identifiers
- CAS
935521-55-4- PubChem CID
- 53316985
- DTXSID
DTXSID601344358- ChEMBL
CHEMBL1668597
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 90.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 711
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Related reactions
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Compound notes
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