Primary Record
J3.648.972C
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 132577036
- SMILES
- CC[C@H]([C@H]1CC[C@@H]([C@@H](O1)[C@@H](C)[C@@H]([C@H](C)C(=O)[C@H](CC)[C@@H]2[C@H](C[C@H]([C@]3(O2)C=C[C@H]([C@@]4(O3)CC[C@@](O4)(C)[C@H]5CC[C@@]([C@@H](O5)C)(CC)O)OC(=O)NCC)C)C)O)C)C(=O)OCC#CC#CCOC(=O)[C@H](CC)[C@H]6CC[C@@H]([C@@H](O6)[C@@H](C)[C@@H]([C@H](C)C(=O)[C@H](CC)[C@@H]7[C@H](C[C@H]([C@]8(O7)C=C[C@H]([C@@]9(O8)CC[C@@](O9)(C)[C@H]1CC[C@@]([C@@H](O1)C)(CC)O)OC(=O)NCC)C)C)O)C
- Canonical SMILES
- CCNC(=O)O[C@@H]1C=C[C@]2(O[C@H]([C@@H](CC)C(=O)[C@@H](C)[C@@H](O)[C@H](C)[C@@H]3O[C@@H]([C@@H](CC)C(=O)OCC#CC#CCOC(=O)[C@H](CC)[C@H]4CC[C@H](C)[C@H]([C@@H](C)[C@H](O)[C@H](C)C(=O)[C@H](CC)[C@H]5O[C@]6(C=C[C@@H](OC(=O)NCC)[C@]7(CC[C@@](C)([C@H]8CC[C@](O)(CC)[C@H](C)O8)O7)O6)[C@H](C)C[C@@H]5C)O4)CC[C@@H]3C)[C@@H](C)C[C@H]2C)O[C@@]12CC[C@@](C)([C@H]1CC[C@](O)(CC)[C@H](C)O1)O2
Names & Synonyms
- J3.648.972C
- Bis[20-deoxy-20-[(ethylcarbamoyl)oxy]salinomycin]2,4-hexadiyne-1,6-diyl ester
- 6-{[(2R)-2-[(2R,5S,6R)-6-[(2S,3S,4S,6R)-6-[(2S,5S,7R,9S,10S,12R,15R)-2-[(2R,5R,6S)-5-ethyl-5-hydroxy-6-methyloxan-2-yl]-15-[(ethylcarbamoyl)oxy]-2,10,12-trimethyl-1,6,8-trioxadispiro[4.1.57.35]pentadec-13-en-9-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-5-methyloxan-2-yl]butanoyl]oxy}hexa-2,4-diyn-1-yl (2R)-2-[(2R,5S,6R)-6-[(2S,3S,4S,6R)-6-[(2S,5S,7R,9S,10S,12R,15R)-2-[(2R,5R,6S)-5-ethyl-5-hydroxy-6-methyloxan-2-yl]-15-[(ethylcarbamoyl)oxy]-2,10,12-trimethyl-1,6,8-trioxadispiro[4.1.57.35]pentadec-13-en-9-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-5-methyloxan-2-yl]butanoate