Basic information
- CAS
131024-87-8- Standard SMILES
OC[C@H]1O[C@@H](Oc2ccc3c4c(cccc24)-c2ccccc2-3)[C@H](O)[C@@H](O)[C@@H]1O- InChIKey
UCSUXNOVPYLKMN-MIUGBVLSSA-N- Molecular formula
- C22H20O6
- Average molar mass
- 380.4 g/mol
- Monoisotopic mass
- 380.12598835
Names & identifiers
- Preferred name
- 3-Fluoranthene-beta-glucopyranoside
- IUPAC
- (2S,3R,4S,5S,6R)-2-fluoranthen-3-yloxy-6-(hydroxymethyl)oxane-3,4,5-triol
Names & synonyms
3-Fluoranthene-beta-glucopyranoside131024-87-83-(8-Hydroxy-fluoranthene)-beta-glucopyranosideFluoranthen-3-yl hexopyranosideDTXSID60927047Fluoranthen-3-yl beta-D-glucopyranoside131024-89-0
Database identifiers
- CAS
131024-87-8、131024-89-0- PubChem CID
- 148347
- DTXSID
DTXSID60927047
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 99.4 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 557
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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