Syringolin C
HIT100318898
sdf文件结构编辑类似物检索
HIT ID: HIT100318898
Cas No: 235096-67-0
分子式: C25H41N5O6
分子量: 507.632
常用名: Syringolin C
氢键受体数 (HBA): 6
氢键供体数 (HBD): 6
LogP: 1.443
IUPAC: 2-{[(1-{[(3E,9E)-2,7-dioxo-5-(propan-2-yl)-1,6-diazacyclododeca-3,9-dien-8-yl]carbamoyl}-2-methylbutyl)carbamoyl]amino}-3-methylbutanoic acid
IUPAC: 2-{[(1-{[(3E,9E)-2,7-dioxo-5-(propan-2-yl)-1,6-diazacyclododeca-3,9-dien-8-yl]carbamoyl}-2-methylbutyl)carbamoyl]amino}-3-methylbutanoic acid
SMILES: CCC(C)C(NC(=O)NC(C(C)C)C(O)=O)C(=O)NC1\C=C\CCNC(=O)\C=C\C(NC1=O)C(C)C |t:20,27|
SMILES: CCC(C)C(NC(=O)NC(C(C)C)C(O)=O)C(=O)NC1\C=C\CCNC(=O)\C=C\C(NC1=O)C(C)C |t:20,27|
InChI key: AXZPAGVFIVOODG-REVVXPLQSA-N
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