Chemical Compound

aeruginosin 98-b

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aeruginosin 98-b chemical structure
Primary Record

aeruginosin 98-b

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
101239377
SMILES
CCC(C)[C@H](C(=O)N1[C@H]2C[C@@H](CC[C@H]2C[C@H]1C(=O)NCCCCN=C(N)N)OS(=O)(=O)O)NC(=O)[C@@H](CC3=CC=C(C=C3)O)O
Canonical SMILES
CCC(C)[C@@H](NC(=O)[C@H](O)Cc1ccc(O)cc1)C(=O)N1[C@H](C(=O)NCCCCN=C(N)N)C[C@@H]2CC[C@@H](OS(=O)(=O)O)C[C@@H]21

Names & Synonyms

  • aeruginosin 98-b
  • J1.892.110C
  • (2S,3abeta,7abeta)-N-(4-Guanidinobutyl)-1-[(2R)-2-[[(2R)-2-hydroxy-3-(4-hydroxyphenyl)propionyl]amino]-3-methylpentanoyl]-6beta-(sulfooxy)octahydro-1H-indole-2alpha-carboxamide
  • [(2S,3aS,6R,7aS)-2-[(4-carbamimidamidobutyl)carbamoyl]-1-[(2R)-2-[(2R)-2-hydroxy-3-(4-hydroxyphenyl)propanamido]-3-methylpentanoyl]-octahydro-1H-indol-6-yl]oxidanesulfonic acid