Moroidin
HIT218850872
sdf文件结构编辑类似物检索
HIT ID: HIT218850872
Cas No: 104041-75-0
分子式: C47H66N14O10
分子量: 987.133
常用名: Moroidin
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 21-(3-carbamimidamidopropyl)-12-(2-methylpropyl)-10,13,16,19,22,25-hexaoxo-9-(5-oxopyrrolidine-2-amido)-8,15-bis(propan-2-yl)-2,11,14,17,20,23,26,30,32-nonaazapentacyclo[16.14.2.1^{3,7}.1^{29,32}.0^{4,33}]hexatriaconta-1(33),3(36),4,6,29(35),30-hexaene-27-carboxylic acid
IUPAC: 21-(3-carbamimidamidopropyl)-12-(2-methylpropyl)-10,13,16,19,22,25-hexaoxo-9-(5-oxopyrrolidine-2-amido)-8,15-bis(propan-2-yl)-2,11,14,17,20,23,26,30,32-nonaazapentacyclo[16.14.2.1^{3,7}.1^{29,32}.0^{4,33}]hexatriaconta-1(33),3(36),4,6,29(35),30-hexaene-27-carboxylic acid
SMILES: CC(C)CC1NC(=O)C(NC(=O)C2CCC(=O)N2)C(C(C)C)c2ccc3c4CC(NC(=O)C(NC1=O)C(C)C)C(=O)NC(CCCNC(N)=N)C(=O)NCC(=O)NC(Cc1cn(cn1)-c4[nH]c3c2)C(O)=O
SMILES: CC(C)CC1NC(=O)C(NC(=O)C2CCC(=O)N2)C(C(C)C)c2ccc3c4CC(NC(=O)C(NC1=O)C(C)C)C(=O)NC(CCCNC(N)=N)C(=O)NCC(=O)NC(Cc1cn(cn1)-c4[nH]c3c2)C(O)=O
InChI key: UCSHFBQCLZMAJY-UHFFFAOYSA-N
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