Aeruginosin 865 | CAS 1611990-01-2

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HIT ID:HIT214322677
Cas No:1611990-01-2
常用名:Aeruginosin 865
IUPAC:(2S,3S,4S,5S,6R)-6-{[(2R,3aR,5S,6S,7aS)-2-[(4-carbamimidamidobutyl)carbamoyl]-5-(hexanoyloxy)-1-[(2R)-2-[(2R)-2-hydroxy-3-(4-hydroxyphenyl)propanamido]-4-methylpentanoyl]-octahydro-1H-indol-6-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
IUPAC:(2S,3S,4S,5S,6R)-6-{[(2R,3aR,5S,6S,7aS)-2-[(4-carbamimidamidobutyl)carbamoyl]-5-(hexanoyloxy)-1-[(2R)-2-[(2R)-2-hydroxy-3-(4-hydroxyphenyl)propanamido]-4-methylpentanoyl]-octahydro-1H-indol-6-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
InChI key:GYBRMQYCKSSXID-RIDHWVDWSA-N

分子式:C41H64N6O14
分子量:864.991
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]12C[C@@H](N(C(=O)[C@@H](CC(C)C)NC(=O)[C@H](O)Cc3ccc(O)cc3)[C@@]1([H])C[C@H](O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@@H]1O)C(O)=O)[C@H](C2)OC(=O)CCCCC)C(=O)NCCCCNC(N)=N
SMILES:[H][C@]12C[C@@H](N(C(=O)[C@@H](CC(C)C)NC(=O)[C@H](O)Cc3ccc(O)cc3)[C@@]1([H])C[C@H](O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@@H]1O)C(O)=O)[C@H](C2)OC(=O)CCCCC)C(=O)NCCCCNC(N)=N

Aeruginosin 865, isolated from terrestrial cyanobacterium Nostoc sp . Luke ová 30/93, is the first aeruginosin-type peptide containing both a fatty acid and a carbohydrate moiety. Aeruginosin 865 inhibits translocation of NF-kB to the nucleus. Aeruginosin 865 has anti-inflammatory effect

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