Products 125774-71-2
CAS 125774-71-2 is the registry number for WS9326A. Offered by: MedChemExpress. Available pack sizes: Get quote.
WS9326A is a cyclodepsipeptide.
Source: ChEBI
| Molecular formula | C54H68N8O13 |
|---|---|
| Molecular weight | 1037.2 g/mol |
| IUPAC name | (E)-N-[(3S,6S,9S,12R,15S,18E,21S,22R)-6-(2-amino-2-oxoethyl)-12-benzyl-9-[(1S)-1-hydroxyethyl]-3-(hydroxymethyl)-18-[(4-hydroxyphenyl)methylidene]-19,22-dimethyl-15-(2-methylpropyl)-2,5,8,11,14,17,20-heptaoxo-1-oxa-4,7,10,13,16,19-hexazacyclodocos-21-yl]-3-[2-[(Z)-pent-1-enyl]phenyl]prop-2-enamide |
| InChIKey | BVVWVQZZLUNSNV-QMXPZCTJSA-N |
| SMILES | CCC/C=C\C1=CC=CC=C1/C=C/C(=O)N[C@H]2[C@H](OC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)/C(=C\C3=CC=C(C=C3)O)/N(C2=O)C)CC(C)C)CC4=CC=CC=C4)[C@H](C)O)CC(=O)N)CO)C |
Computed by PubChem (NCBI)