Name: Coumamidine γ2
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT219599694
Cas No:121634-34-2
常用名:Coumamidine γ2
IUPAC:3-(4-{[3-carbamimidamido-5-({[3-(carbamoylamino)-5-{[7-(carbamoylamino)-2-oxo-hexahydro-1H-pyrano[4,3-d][1,3]oxazol-6-yl]oxy}-4-hydroxyoxan-2-yl]carbamoyl}amino)-4-hydroxy-6-methyloxan-2-yl]oxy}phenyl)-N-(2-carbamimidoylethyl)prop-2-enamide
IUPAC:3-(4-{[3-carbamimidamido-5-({[3-(carbamoylamino)-5-{[7-(carbamoylamino)-2-oxo-hexahydro-1H-pyrano[4,3-d][1,3]oxazol-6-yl]oxy}-4-hydroxyoxan-2-yl]carbamoyl}amino)-4-hydroxy-6-methyloxan-2-yl]oxy}phenyl)-N-(2-carbamimidoylethyl)prop-2-enamide
InChI key:XISLFTSSEBTNHP-UHFFFAOYSA-N

分子式:C33H49N13O13
分子量:835.833
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC1OC(Oc2ccc(C=CC(=O)NCCC(N)=N)cc2)C(NC(N)=N)C(O)C1NC(=O)NC1OCC(OC2OCC3OC(=O)NC3C2NC(N)=O)C(O)C1NC(N)=O
SMILES:CC1OC(Oc2ccc(C=CC(=O)NCCC(N)=N)cc2)C(NC(N)=N)C(O)C1NC(=O)NC1OCC(OC2OCC3OC(=O)NC3C2NC(N)=O)C(O)C1NC(N)=O

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