| Catalog Number |
ACM82005127 |
| CAS |
82005-12-7 |
| Structure |
![{[CAS...OR...Name]}](https://resource.alfa-chemistry.com/structure/82005-12-7.gif) |
| Description |
10Z-Hymenialdisine is a natural bioactive pyrrole alkaloid. |
| Synonyms |
Hymenialdisine |
| IUPAC Name |
(4Z)-4-(2-Amino-5-oxo-1H-imidazol-4-ylidene)-2-bromo-1,5,6,7-tetrahydropyrrolo[2,3-c]azepin-8-one |
| Molecular Weight |
324.13 |
| Canonical SMILES |
C1CNC(=O)C2=C(C1=C3C(=O)NC(=N3)N)C=C(N2)Br |
| InChI |
InChI=1S/C11H10BrN5O2/c12-6-3-5-4(7-10(19)17-11(13)16-7)1-2-14-9(18)8(5)15-6/h3,15H,1-2H2,(H,14,18)(H3,13,16,17,19)/b7-4- |
| InChI Key |
ATBAETXFFCOZOY-DAXSKMNVSA-N |
| Purity |
95%+ |
| Complexity |
515 |
| Covalently-Bonded Unit Count |
1 |
| Defined Atom Stereocenter Count |
0 |
| Exact Mass |
323.00179 |
| Heavy Atom Count |
19 |
| Isomeric SMILES |
C\1CNC(=O)C2=C(/C1=C\3/C(=O)NC(=N3)N)C=C(N2)Br |
| Monoisotopic Mass |
323.00179 |
| Physical State |
Powder |
| Storage Conditions |
Powder: -20°C for 3 years
In solvent: -80°C for 2 years |
| Topological Polar Surface Area |
112 Ų |
For Research Use Only. Not for use in diagnostic or therapeutic procedures.
