Adnamine
2-(methylaminomethyl)tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaene-5,6,13,14-tetrol
Also Known As: Adnamine|Adrenaline Impurity 51|5-[methyl]-5h-dibenzo[a,d]cycloheptene-2,3,7,8-tetrol|5-[ methyl]-5H-dibenzo[a,d]cycloheptene-2,3,7,8-tetrol|5-((methylamino)methyl)-5H-dibenzo[a,d][7]annulene-2,3,7,8-tetraol|5-[(Methylamino)methyl]-5H-dibenzo[a,d]cycloheptene-2,3,7,8-tetrol|5-[(Methylamino)methyl]-5H-dibenzo[a,d]cycloheptene-2,3,7,8-tetrol #|5H-Dibenzo[a,d]cycloheptene-2,3,7,8-tetrol, 5-[(methylamino)methyl]-|2-[(methylamino)methyl]tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaene-5,6,13,14-tetrol
| Molecular Formula | C17H17NO4 |
|---|---|
| Molecular Weight | 299.11575 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 93.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 299.11575 |
| Monoisotopic Mass | 299.11575 |
| Heavy Atoms | 22 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 481-90-3 |
|---|---|
| SMILES | CNCC1C2=CC(=C(C=C2C=CC3=CC(=C(C=C13)O)O)O)O |
| InChIKey | LTLXWGYCUKUMBX-UHFFFAOYSA-N |
Product Overview
Adnamine (CAS 481-90-3), with molecular formula C17H17NO4 and molecular weight 299.11575 g/mol. IUPAC: 2-(methylaminomethyl)tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaene-5,6,13,14-tetrol.