Cacotheline Monohydrate, >98.0%(T)
cas: 561-20-6 — see every product listed under this CAS number, including other names
Cacotheline Monohydrate, >98.0%(T) (CAS 561-20-6) is a chemical reagent available from Chemat. Available pack sizes: 1g, 5g. Offered by: TCI.
| brand | TCI |
|---|---|
| catalog number | C0001-1G |
| cas | 561-20-6 |
| size | 1g |
| availability | 2 tygodnie|2 weeks |
Documents:
Safety Data Sheet (MSDS)
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Available pack sizes
| brand | size | price | |
|---|---|---|---|
| TCI | 1g | 218.18 Pln | |
| TCI | 5g | 483.71 Pln |
properties
| delivery time | 2 weeks |
|---|---|
| category | chemicals |
| purity | >98.0%(T) |
2-[(4S,12S,13R,14S,19R,21S)-9-nitro-7,8-dioxo-15-oxa-1,11-diazahexacyclo[16.3.1.04,12.04,21.05,10.013,19]docosa-5,9,17-trien-14-yl]acetic acid (CAS 561-20-6) is a chemical compound with the molecular formula C21H21N3O7 and a molecular weight of 427.4 g/mol. IUPAC name: 2-[(4S,12S,13R,14S,19R,21S)-9-nitro-7,8-dioxo-15-oxa-1,11-diazahexacyclo[16.3.1.04,12.04,21.05,10.013,19]docosa-5,9,17-trien-14-yl]acetic acid. InChIKey: IVEMPCACOMNRGI-OFDJEBHLSA-N.
| Molecular formula | C21H21N3O7 |
|---|---|
| Molecular weight | 427.4 g/mol |
| IUPAC name | 2-[(4S,12S,13R,14S,19R,21S)-9-nitro-7,8-dioxo-15-oxa-1,11-diazahexacyclo[16.3.1.04,12.04,21.05,10.013,19]docosa-5,9,17-trien-14-yl]acetic acid |
| InChIKey | IVEMPCACOMNRGI-OFDJEBHLSA-N |
| SMILES | C1CN2CC3=CCO[C@H]([C@@H]4[C@H]3C[C@H]2[C@@]15[C@H]4NC6=C(C(=O)C(=O)C=C56)[N+](=O)[O-])CC(=O)O |
Computed by PubChem (NCBI)
Synonyms:
Cacotheline, KACOTHELINE, CACOTHELINE [MI], 2,3-dihydro-4-nitro-2,3-dioxo-9,10-secostrychnidin-10-oic acid, 9,10-Secostrychnidin-10-oic acid, 2,3-dihydro-4-nitro-2,3-dioxo-, 2,3dihydro4nitro2,3dioxo9,10secostrychnidin10oic acid, 9,10Secostrychnidin10oic acid, 2,3dihydro4nitro2,3dioxo, 9,10Secostrychnidin10oic acid, 2,3dihydro4nitro2,3dioxo (9CI), 9,10-Secostrychnidin-10-oic acid, 2,3-dihydro-4-nitro-2,3-dioxo-(9CI), Cacotheline monohydrate