Chemical Compound

RefChem:78963

RefChem:78963 chemical structure
Primary Record

RefChem:78963

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
139584420
SMILES
CC/C(=C\C=C\[C@H]1C=C[C@H]2CCC[C@@H]2[C@H]1C(=O)C3=CC=CN3)/[C@@H]4[C@@H](CC[C@H](O4)[C@@H](C)C(=O)OC)C
Canonical SMILES
CC/C(=C\C=C\[C@H]1C=C[C@H]2CCC[C@@H]2[C@H]1C(=O)c1ccc[nH]1)[C@H]1O[C@H]([C@@H](C)C(=O)OC)CC[C@H]1C

Names & Synonyms

  • RefChem:78963
  • 16-deethylindanomycin methyl ester
  • CHEBI:202013
  • methyl (2R)-2-[(2S,5R,6S)-6-[(3E,5E)-6-[(3aS,4R,5R,7aR)-4-(1H-pyrrole-2-carbonyl)-2,3,3a,4,5,7a-hexahydro-1H-inden-5-yl]hexa-3,5-dien-3-yl]-5-methyloxan-2-yl]propanoate
  • Methyl (2R)-2-((2S,5R,6S)-6-((3E)-6-((3as,4R,5R,7ar)-4-(1H-pyrrole-2-carbonyl)-2,3,3a,4,5,7a-hexahydro-1H-inden-5-yl)hexa-3,5-dien-3-yl)-5-methyloxan-2-yl)propanoic acid
  • methyl (2R)-2-((2S,5R,6S)-6-((3E,5E)-6-((3aS,4R,5R,7aR)-4-(1H-pyrrole-2-carbonyl)-2,3,3a,4,5,7a-hexahydro-1H-inden-5-yl)hexa-3,5-dien-3-yl)-5-methyloxan-2-yl)propanoate
  • Methyl (2R)-2-[(2S,5R,6S)-6-[(3E)-6-[(3as,4R,5R,7ar)-4-(1H-pyrrole-2-carbonyl)-2,3,3a,4,5,7a-hexahydro-1H-inden-5-yl]hexa-3,5-dien-3-yl]-5-methyloxan-2-yl]propanoic acid