Glutinosone
Basic information
- CAS
55051-94-0- Standard SMILES
C=C(C)[C@@H]1CCC2=CC(=O)[C@H](O)[C@@H](C)[C@@H]2C1- InChIKey
AUWWCTMETLOZSD-HEQLZXTPSA-N- Molecular formula
- C14H20O2
- Average molar mass
- 220.31 g/mol
- Monoisotopic mass
- 220.14632988
Overview
Glutinosone is a secondary alcohol.
Names & identifiers
- Preferred name
- Glutinosone
- IUPAC
- (3R,4S,4aS,6R)-3-hydroxy-4-methyl-6-prop-1-en-2-yl-4,4a,5,6,7,8-hexahydro-3H-naphthalen-2-one
Names & synonyms
Glutinosone55051-94-0C09673(3R,4S,4aS,6R)-3-hydroxy-4-methyl-6-prop-1-en-2-yl-4,4a,5,6,7,8-hexahydro-3H-naphthalen-2-oneAC1L9CP5CHEBI:5440SCHEMBL31357267DTXSID30970409Q271067703-Hydroxy-4-methyl-6-(prop-1-en-2-yl)-4,4a,5,6,7,8-hexahydronaphthalen-2(3H)-one(3R,4S,4aS,6R)-3-Hydroxy-4-methyl-6-(prop-1-en-2-yl)-4,4a,5,6,7,8-hexahydronaphthalen-2(3H)-one(3R,4S,4aS,6R)-3-hydroxy-6-isopropenyl-4-methyl-4,4a,5,6,7,8-hexahydro-3H-naphthalen-2-one
Database identifiers
- CAS
55051-94-0- PubChem CID
- 442371
- DTXSID
DTXSID30970409- ChEBI
CHEBI:5440- Nikkaji
- J12.405B
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 354
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Related reactions
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Compound notes
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