Produkty 403479-63-0
CAS 403479-63-0 to numer rejestracyjny substancji Scyptolin B. Oferty producentów: MedChemExpress. Dostępne opakowania: Get quote.
[3-[[(2S)-2-(butanoylamino)propanoyl]amino]-4-[[(2S,5S,8S,11R,12S,15S,18R,21R)-5-[(3-chloro-4-hydroxyphenyl)methyl]-21-hydroxy-2-(1-hydroxyethyl)-4,11-dimethyl-15-(2-methylpropyl)-3,6,9,13,16,22-hexaoxo-8-propan-2-yl-10-oxa-1,4,7,14,17-pentazabicyclo[16.3.1]docosan-12-yl]amino]-4-oxobutan-2-yl] (2S)-2-(butanoylamino)propanoate (CAS 403479-63-0) to związek chemiczny o wzorze sumarycznym C52H80ClN9O16 i masie molowej 1122.7 g/mol. Nazwa systematyczna IUPAC: [3-[[(2S)-2-(butanoylamino)propanoyl]amino]-4-[[(2S,5S,8S,11R,12S,15S,18R,21R)-5-[(3-chloro-4-hydroxyphenyl)methyl]-21-hydroxy-2-(1-hydroxyethyl)-4,11-dimethyl-15-(2-methylpropyl)-3,6,9,13,16,22-hexaoxo-8-propan-2-yl-10-oxa-1,4,7,14,17-pentazabicyclo[16.3.1]docosan-12-yl]amino]-4-oxobutan-2-yl] (2S)-2-(butanoylamino)propanoate. InChIKey: KEOLGCFLKHISHR-SDKJDEFNSA-N.
| Wzór sumaryczny | C52H80ClN9O16 |
|---|---|
| Masa molowa | 1122.7 g/mol |
| Nazwa IUPAC | [3-[[(2S)-2-(butanoylamino)propanoyl]amino]-4-[[(2S,5S,8S,11R,12S,15S,18R,21R)-5-[(3-chloro-4-hydroxyphenyl)methyl]-21-hydroxy-2-(1-hydroxyethyl)-4,11-dimethyl-15-(2-methylpropyl)-3,6,9,13,16,22-hexaoxo-8-propan-2-yl-10-oxa-1,4,7,14,17-pentazabicyclo[16.3.1]docosan-12-yl]amino]-4-oxobutan-2-yl] (2S)-2-(butanoylamino)propanoate |
| InChIKey | KEOLGCFLKHISHR-SDKJDEFNSA-N |
| SMILES | CCCC(=O)N[C@@H](C)C(=O)NC(C(C)OC(=O)[C@H](C)NC(=O)CCC)C(=O)N[C@H]1[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N2[C@@H](CC[C@H](C2=O)NC(=O)[C@@H](NC1=O)CC(C)C)O)C(C)O)C)CC3=CC(=C(C=C3)O)Cl)C(C)C)C |
Dane obliczone przez PubChem (NCBI)
Synonimy:
Scyptolin B