Basic information
- CAS
30517-65-8- Standard SMILES
O=C1c2cccc(O)c2C(=O)c2c1cc1c(c2O)C2C=COC2O1- InChIKey
QLPXJOSOFOPAMO-UHFFFAOYSA-N- Molecular formula
- C18H10O6
- Average molar mass
- 322.3 g/mol
- Monoisotopic mass
- 322.04773803
Names & identifiers
- Preferred name
- 2,18-Dihydroxy-7,9-dioxapentacyclo[10.8.0.03,10.04,8.014,19]icosa-1,3(10),5,11,14(19),15,17-heptaene-13,20-dione
- IUPAC
- 2,18-dihydroxy-7,9-dioxapentacyclo[10.8.0.03,10.04,8.014,19]icosa-1,3(10),5,11,14(19),15,17-heptaene-13,20-dione
Names & synonyms
30517-65-8DTXSID309528264,6-Dihydroxy-3a,12a-dihydroanthra[2,3-b]furo[3,2-d]furan-5,10-dione
Database identifiers
- CAS
30517-65-8- PubChem CID
- 147356
- DTXSID
DTXSID30952826
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 93.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 615
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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