Primary Record
Grahamine E
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 101539051
- SMILES
- C/C=C(/C)\C(=O)O[C@@H]1CC2C[C@H](CC1N2C)OC(=O)[C@@H]3[C@H]([C@@H]([C@]3(C)C(=O)O[C@@H]4CC5C[C@H](CC4N5C)O)C(=O)O[C@@H]6CC7C[C@H](CC6N7C)OC(=O)/C=C(\C)/C(=O)O)C8=CC=CC=C8
- Canonical SMILES
- C/C=C(/C)C(=O)O[C@@H]1CC2C[C@@H](OC(=O)[C@@H]3[C@@H](c4ccccc4)[C@H](C(=O)O[C@@H]4CC5C[C@@H](OC(=O)/C=C(\C)C(=O)O)CC4N5C)[C@]3(C)C(=O)O[C@@H]3CC4C[C@@H](O)CC3N4C)CC1N2C
Names & Synonyms
- Grahamine E
- J3.007.847K
- (2E)-4-{[(3R,6R)-6-[(1S,2R,3R,4R)-2-({[(3R,6R)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-6-yl]oxy}carbonyl)-2-methyl-3-({[(3R,6R)-8-methyl-6-{[(2Z)-2-methylbut-2-enoyl]oxy}-8-azabicyclo[3.2.1]octan-3-yl]oxy}carbonyl)-4-phenylcyclobutanecarbonyloxy]-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]oxy}-2-methyl-4-oxobut-2-enoic acid
- (E)-2-Methyl-4-[[(3R,6R)-8-methyl-6-[[(1S)-2alpha-[[[(3R,6R)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-6-yl]oxy]carbonyl]-2-methyl-3alpha-[[[(3R,6R)-6-(angeloyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-3-yl]oxy]carbonyl]-4beta-phenylcyclobutane-1alpha-yl]carbonyloxy]-8-azabicyclo[3.2.1]octane-3-yl]oxy]-4-oxo-2-butenoic acid