Arylomycin A1
HIT219251631
sdf文件结构编辑类似物检索
HIT ID: HIT219251631
Cas No: 459844-19-0
分子式: C41H58N6O11
分子量: 810.946
常用名: Arylomycin A1
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (11S)-14-{2-[(2R)-2-[(2R)-2-(N,9-dimethyldecanamido)-3-hydroxypropanamido]propanamido]-N-methylacetamido}-3,18-dihydroxy-11-methyl-10,13-dioxo-9,12-diazatricyclo[13.3.1.1^{2,6}]icosa-1(18),2(20),3,5,15(19),16-hexaene-8-carboxylic acid
IUPAC: (11S)-14-{2-[(2R)-2-[(2R)-2-(N,9-dimethyldecanamido)-3-hydroxypropanamido]propanamido]-N-methylacetamido}-3,18-dihydroxy-11-methyl-10,13-dioxo-9,12-diazatricyclo[13.3.1.1^{2,6}]icosa-1(18),2(20),3,5,15(19),16-hexaene-8-carboxylic acid
SMILES: CC(C)CCCCCCCC(=O)N(C)[C@H](CO)C(=O)N[C@H](C)C(=O)NCC(=O)N(C)C1c2ccc(O)c(c2)-c2cc(CC(NC(=O)[C@H](C)NC1=O)C(O)=O)ccc2O
SMILES: CC(C)CCCCCCCC(=O)N(C)[C@H](CO)C(=O)N[C@H](C)C(=O)NCC(=O)N(C)C1c2ccc(O)c(c2)-c2cc(CC(NC(=O)[C@H](C)NC1=O)C(O)=O)ccc2O
InChI key: LNVQPJGJVYGJKF-SBKIGQFHSA-N
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