Goniodiol
Basic information
- CAS
96422-52-5- Standard SMILES
O=C1C=CC[C@H]([C@H](O)[C@H](O)c2ccccc2)O1- InChIKey
RTNQVKQMVIXUPZ-RTXFEEFZSA-N- Molecular formula
- C13H14O4
- Average molar mass
- 234.25 g/mol
- Monoisotopic mass
- 234.08920892
Overview
Goniodiol has been reported in Goniothalamus amuyon, Goniothalamus griffithii, and other organisms with data available.
Names & identifiers
- Preferred name
- Goniodiol
- IUPAC
- (2R)-2-[(1R,2R)-1,2-dihydroxy-2-phenylethyl]-2,3-dihydropyran-6-one
- English name
- (6R)-6-[(1R,2R)-1,2-Dihydroxy-2-phenylethyl]-5,6-dihydro-2H-pyran-2-one
- Molecular formula
- C13H14O4
- Molecular weight
- 234.25
Names & synonyms
GONIODIOL96422-52-5DTXSID70242253(2R)-2-[(1R,2R)-1,2-dihydroxy-2-phenylethyl]-2,3-dihydropyran-6-one(2R)-2-((1R,2R)-1,2-dihydroxy-2-phenylethyl)-2,3-dihydropyran-6-oneRefChem:144136DTXCID70164744(6R)-6-[(1R,2R)-1,2-DIHYDROXY-2-PHENYLETHYL]-5,6-DIHYDRO-2H-PYRAN-2-ONE(+)-GoniodiolStereoisomer of GoniodiolCHEMBL490371orb1682474
Show more names
2H-Pyran-2-one, 6-[(1R,2R)-1,2-dihydroxy-2-phenylethyl]-5,6-dihydro-, (6R)-
SCHEMBL2329557(R)-6-((1R,2R)-1,2-Dihydroxy-2-phenylethyl)-5,6-dihydro-2H-pyran-2-oneHY-N3964TN4159AKOS032948955FS-86372H-Pyran-2-one, 6-[(1R,2R)-1,2-dihydroxy-2-phenylethyl]-5,6-dihydro-,(6R)-DA-73844
Database identifiers
- CAS
96422-52-5- PubChem CID
- 180702
- DTXSID
DTXSID70242253- ChEMBL
CHEMBL490371- Nikkaji
- J1.781.968B
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 294
Chemistry & industry
Applications
UsesGoniodiol (compound 5) is a natural producr that can be found in Goniothalamus cardiopetalus[1].
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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