Malonylniphimycin | CAS 200498-88-0 | AnyMole

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HIT219619041

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HIT219619041

HIT ID:HIT219619041
Cas No:200498-88-0
常用名:Malonylniphimycin
IUPAC:3-({3-[(2-carboxyacetyl)oxy]-5,7,9,19,23,25,27,31,33,34-decahydroxy-8,14,18,22,26,30-hexamethyl-15-[4-methyl-12-(N'-methylcarbamimidamido)dodec-8-en-2-yl]-17-oxo-16,37-dioxabicyclo[31.3.1]heptatriaconta-10,12,20-trien-35-yl}oxy)-3-oxopropanoic acid
IUPAC:3-({3-[(2-carboxyacetyl)oxy]-5,7,9,19,23,25,27,31,33,34-decahydroxy-8,14,18,22,26,30-hexamethyl-15-[4-methyl-12-(N'-methylcarbamimidamido)dodec-8-en-2-yl]-17-oxo-16,37-dioxabicyclo[31.3.1]heptatriaconta-10,12,20-trien-35-yl}oxy)-3-oxopropanoic acid
InChI key:InChIKey=XZXMNJUMFYDZBE-UHFFFAOYSA-N

分子式:C62H105N3O21
分子量:1228.522
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CNC(=N)NCCCC=CCCCC(C)CC(C)C1OC(=O)C(C)C(O)C=CC(C)C(O)CC(O)C(C)C(O)CCC(C)C(O)CC2(O)OC(CC(OC(=O)CC(O)=O)C2O)CC(CC(O)CC(O)C(C)C(O)C=CC=CC1C)OC(=O)CC(O)=O
SMILES:CNC(=N)NCCCC=CCCCC(C)CC(C)C1OC(=O)C(C)C(O)C=CC(C)C(O)CC(O)C(C)C(O)CCC(C)C(O)CC2(O)OC(CC(OC(=O)CC(O)=O)C2O)CC(CC(O)CC(O)C(C)C(O)C=CC=CC1C)OC(=O)CC(O)=O

Malonylniphimycin 是一种大环内酯类抗生素，对革兰氏阳性细菌、真菌和酵母菌显示出抗药性。

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