Chemical Compound

J1.287.775G

J1.287.775G chemical structure
Primary Record

J1.287.775G

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177494853
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N(CCCC(=O)NCCNC(=O)CCC[C@@H]2CC3=C(C=CC(=C3)O)[C@@H]4[C@@H]2[C@@H]5CC[C@@H]([C@]5(CC4)C)O)C(=O)C6=C7C=CC=CC7=[N+](C8=CC=CC=C86)CCCS(=O)(=O)[O-]
Canonical SMILES
Cc1ccc(S(=O)(=O)N(CCCC(=O)NCCNC(=O)CCC[C@@H]2Cc3cc(O)ccc3[C@H]3CC[C@]4(C)[C@@H](O)CC[C@H]4[C@H]23)C(=O)c2c3ccccc3[n+](CCCS(=O)(=O)[O-])c3ccccc23)cc1

Names & Synonyms

  • J1.287.775G
  • 9-({3-[(2-{4-[(1S,3aS,3bR,4R,9bS,11aS)-1,7-dihydroxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-4-yl]butanamido}ethyl)carbamoyl]propyl}(4-methylbenzenesulfonyl)carbamoyl)-10-(3-sulfonatopropyl)acridin-10-ium
  • 9-[4-[[2-[[4-[(17beta)-Estradiol-7alpha-yl]butyryl]amino]ethyl]amino]-4-oxobutyl(4-methylphenylsulfonyl)carbamoyl]-10-(3-sulfonatopropyl)acridinium