Splendidin
Basic information
- CAS
71135-81-4- Standard SMILES
CC(=O)OC1C=CC2C(=O)OCC23CCC2C(=O)OC(c4ccoc4)C(OC(C)=O)C2(C)C13- InChIKey
ODSSLHDHIUPAGJ-UHFFFAOYSA-N- Molecular formula
- C24H26O9
- Average molar mass
- 458.5 g/mol
- Monoisotopic mass
- 458.1576824
Names & identifiers
- Preferred name
- Splendidin
- IUPAC
- [8-acetyloxy-7-(furan-3-yl)-9-methyl-5,15-dioxo-6,16-dioxatetracyclo[8.7.0.01,14.04,9]heptadec-12-en-11-yl] acetate
Names & synonyms
NSC32950171135-81-4SPLENDIDINSCHEMBL31571708DTXSID00330899NSC-3295013-(Furan-3-yl)-4a-methyl-1,8-dioxo-3,4,4a,4b,5,7a,8,11,12,12a-decahydro-1H,10H-furo[3',4':4a,5]naphtho[2,1-c]pyran-4,5-diyl diacetate
Database identifiers
- CAS
71135-81-4- PubChem CID
- 433422
- DTXSID
DTXSID00330899
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 912
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…