Basic information
- CAS
89368-92-3- Standard SMILES
COc1ccc2c([nH]c3c(O)c(-c4c(C)cc5c([nH]c6c(CC=C(C)C)c(OC)ccc65)c4O)c(C)cc32)c1CC=C(C)C- InChIKey
STVAUJYOJBWBNS-UHFFFAOYSA-N- Molecular formula
- C38H40N2O4
- Average molar mass
- 588.7 g/mol
- Monoisotopic mass
- 588.29880776
Overview
2-[1-hydroxy-7-methoxy-3-methyl-8-(3-methylbut-2-enyl)-9H-carbazol-2-yl]-7-methoxy-3-methyl-8-(3-methylbut-2-enyl)-9H-carbazol-1-ol has been reported in Murraya euchrestifolia with data available.
Names & identifiers
- Preferred name
- Bismurrayafoline B
- IUPAC
- 2-[1-hydroxy-7-methoxy-3-methyl-8-(3-methylbut-2-enyl)-9H-carbazol-2-yl]-7-methoxy-3-methyl-8-(3-methylbut-2-enyl)-9H-carbazol-1-ol
- English name
- 7,7'-Dimethoxy-3,3'-dimethyl-8,8'-bis(3-methyl-2-butenyl)-2,2'-bi[9H-carbazole]-1,1'-diol
- Molecular formula
- C38H40N2O4
- Molecular weight
- 588.7352
Names & synonyms
Bismurrayafoline BDTXSID703274132-[1-hydroxy-7-methoxy-3-methyl-8-(3-methylbut-2-enyl)-9H-carbazol-2-yl]-7-methoxy-3-methyl-8-(3-methylbut-2-enyl)-9H-carbazol-1-ol2-(1-hydroxy-7-methoxy-3-methyl-8-(3-methylbut-2-enyl)-9H-carbazol-2-yl)-7-methoxy-3-methyl-8-(3-methylbut-2-enyl)-9H-carbazol-1-olRefChem:120412DTXCID60278526NSC654279CHEMBL510968NSC-6542797,7'-DIMETHOXY-3,3'-DIMETHYL-8,8'-BIS(3-METHYLBUT-2-EN-1-YL)-9H,9'H-[2,2'-BICARBAZOLE]-1,1'-DIOL89368-92-3NCI60_018843
Show more names
7,7'-Dimethoxy-3,3'-dimethyl-8,8'-bis(3-methyl-2-butenyl)-2,2'-bi[9H-carbazole]-1,1'-diol
Database identifiers
- CAS
89368-92-3
Properties
Computed structural properties
- XLogP
- 10.3
- Topological polar surface area
- 90.5 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 971
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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