Products 445493-22-1

CAS 445493-22-1 is the registry number for Pladienolide A, 99.74%. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

(4R,7R,8S,9E,11S,12S)-4,7,8-trihydroxy-12-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-7,11-dimethyl-1-oxacyclododec-9-en-2-one (CAS 445493-22-1) is a chemical compound with the molecular formula C28H46O7 and a molecular weight of 494.7 g/mol. IUPAC name: (4R,7R,8S,9E,11S,12S)-4,7,8-trihydroxy-12-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-7,11-dimethyl-1-oxacyclododec-9-en-2-one. InChIKey: LTXWIJFJMWETHY-VZSAGGBRSA-N.

Identity
Molecular formulaC28H46O7
Molecular weight494.7 g/mol
IUPAC name(4R,7R,8S,9E,11S,12S)-4,7,8-trihydroxy-12-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3S)-3-hydroxypentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-7,11-dimethyl-1-oxacyclododec-9-en-2-one
InChIKeyLTXWIJFJMWETHY-VZSAGGBRSA-N
SMILESCC[C@@H]([C@@H](C)[C@@H]1[C@H](O1)C[C@H](C)/C=C/C=C(\C)/[C@@H]2[C@H](/C=C/[C@@H]([C@](CC[C@H](CC(=O)O2)O)(C)O)O)C)O

Computed by PubChem (NCBI)