Products 79190-00-4

CAS 79190-00-4 is the registry number for Kirrothricin. Offered by: MedChemExpress. Available pack sizes: Get quote.

Structural formula: {0} (CAS {1})

Kirrothricin is a member of piperidones.

Source: ChEBI

Identity
Molecular formulaC44H64N2O10
Molecular weight781.0 g/mol
IUPAC name(2S)-2-[(2S,4S,6S)-2,4-dihydroxy-5,5-dimethyl-6-[(1E,3Z)-penta-1,3-dienyl]oxan-2-yl]-N-[(2E,4E,6S,7S,8S,9S,10E,12E,14E,16E)-8,9,18-trihydroxy-6-methoxy-5,7,17-trimethyl-18-(1-methyl-2,4-dioxopiperidin-3-ylidene)octadeca-2,4,10,12,14,16-hexaenyl]butanamide
InChIKeySUMCRDMQIVHXRY-SUHFUJLHSA-N
SMILESCC[C@H](C(=O)NC/C=C/C=C(\C)/[C@H]([C@@H](C)[C@@H]([C@H](/C=C/C=C/C=C/C=C(\C)/C(=C1C(=O)CCN(C1=O)C)O)O)O)OC)[C@@]2(C[C@@H](C([C@@H](O2)/C=C/C=C\C)(C)C)O)O

Computed by PubChem (NCBI)

Synonyms: Kirrothricin