CAS 111755-37-4 appears in our catalog under these names: Microcystin-RR, 98%, Microcystin-RR, Microcystin–RR, Microcystin RR from algae, MICROCYSTIN-RR SOLUTION OEKANAL, 10 5G/M. Offered by: Chemat Brand, GLPBio, Biosynth, Sigma-Aldrich. Available pack sizes: on request, 100µg, 25ug, 50ug, 100ug, 250ug, 500ug, 1ML.
Microcystin RR is a microcystin consisting of D-alanyl, L-arginyl, (3S)-3-methyl-D-beta-aspartyl, L-arginyl, (2S,3S,4E,6E,8S,9S)-3-amino-4,5,6,7-tetradehydro-9-methoxy-2,6,8-trimethyl-10-phenyldecanoyl, D-gamma-glutamyl, and 2,3-didehydro-N-methylalanyl residues joined into a 25-membered macrocycle. It has a role as a xenobiotic, a bacterial metabolite and an environmental contaminant. It is a microcystin and an organic molecular entity.
Source: ChEBI
| Molecular formula | C49H75N13O12 |
|---|---|
| Molecular weight | 1038.2 g/mol |
| IUPAC name | (5R,8S,11R,12S,15S,18S,19S,22R)-8,15-bis[3-(diaminomethylideneamino)propyl]-18-[(1E,3E,5S,6S)-6-methoxy-3,5-dimethyl-7-phenylhepta-1,3-dienyl]-1,5,12,19-tetramethyl-2-methylidene-3,6,9,13,16,20,25-heptaoxo-1,4,7,10,14,17,21-heptazacyclopentacosane-11,22-dicarboxylic acid |
| InChIKey | JIGDOBKZMULDHS-UUHBQKJESA-N |
| SMILES | C[C@H]1[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)C(=C)N(C(=O)CC[C@@H](NC1=O)C(=O)O)C)C)CCCN=C(N)N)C(=O)O)C)CCCN=C(N)N)/C=C/C(=C/[C@H](C)[C@H](CC2=CC=CC=C2)OC)/C |
Computed by PubChem (NCBI)