2,2',3,3',4,4'-Hexamethoxy-7,7'-dimethyl-5,5'-di(propan-2-yl)-2h,2'h-8,8'-binaphtho[1,8-bc]furan
Basic information
- CAS
31591-07-8- Standard SMILES
COc1c(OC)c2c3c(c(-c4c(C)cc5c(C(C)C)c(OC)c(OC)c6c5c4OC6OC)c(C)cc3c1C(C)C)OC2OC- InChIKey
UWDFASQFKMYRRO-UHFFFAOYSA-N- Molecular formula
- C36H42O8
- Average molar mass
- 602.7 g/mol
- Monoisotopic mass
- 602.28796829
Names & identifiers
- Preferred name
- 2,2',3,3',4,4'-Hexamethoxy-7,7'-dimethyl-5,5'-di(propan-2-yl)-2h,2'h-8,8'-binaphtho[1,8-bc]furan
- IUPAC
- 3,5,6-trimethoxy-10-methyl-7-propan-2-yl-11-(3,5,6-trimethoxy-10-methyl-7-propan-2-yl-2-oxatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaen-11-yl)-2-oxatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaene
Names & synonyms
31591-07-82,2',3,3',4,4'-hexamethoxy-7,7'-dimethyl-5,5'-di(propan-2-yl)-2h,2'h-8,8'-binaphtho[1,8-bc]furanNSC159494CHEMBL575589SCHEMBL2622262DTXSID20303641(-)-GOSSYPOL HEXAMETHYL ETHERNSC-159494
Database identifiers
- CAS
31591-07-8- PubChem CID
- 293171
- DTXSID
DTXSID20303641- ChEMBL
CHEMBL575589
Properties
Computed structural properties
- XLogP
- 8
- Topological polar surface area
- 73.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 9
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 900
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Compound notes
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