Name: FURA-PE3/AM
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT218848063
Cas No:172890-84-5
常用名:FURA-PE3/AM
IUPAC:(acetyloxy)methyl 2-({2-[(acetyloxy)methoxy]-2-oxoethyl}[5-(2-{5-[3-(4-{2-[(acetyloxy)methoxy]-2-oxoethyl}piperazin-1-yl)-3-oxopropyl]-2-[bis({2-[(acetyloxy)methoxy]-2-oxoethyl})amino]phenoxy}ethoxy)-2-(5-{[(acetyloxy)methoxy]carbonyl}-1,3-oxazol-2-yl)-1-benzofuran-6-yl]amino)acetate
IUPAC:(acetyloxy)methyl 2-({2-[(acetyloxy)methoxy]-2-oxoethyl}[5-(2-{5-[3-(4-{2-[(acetyloxy)methoxy]-2-oxoethyl}piperazin-1-yl)-3-oxopropyl]-2-[bis({2-[(acetyloxy)methoxy]-2-oxoethyl})amino]phenoxy}ethoxy)-2-(5-{[(acetyloxy)methoxy]carbonyl}-1,3-oxazol-2-yl)-1-benzofuran-6-yl]amino)acetate
InChI key:CGAZNAYDEAJZHQ-UHFFFAOYSA-N

分子式:C55H63N5O29
分子量:1258.115
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(=O)OCOC(=O)CN(CC(=O)OCOC(C)=O)c1ccc(CCC(=O)N2CCN(CC(=O)OCOC(C)=O)CC2)cc1OCCOc1cc2cc(oc2cc1N(CC(=O)OCOC(C)=O)CC(=O)OCOC(C)=O)-c1ncc(o1)C(=O)OCOC(C)=O
SMILES:CC(=O)OCOC(=O)CN(CC(=O)OCOC(C)=O)c1ccc(CCC(=O)N2CCN(CC(=O)OCOC(C)=O)CC2)cc1OCCOc1cc2cc(oc2cc1N(CC(=O)OCOC(C)=O)CC(=O)OCOC(C)=O)-c1ncc(o1)C(=O)OCOC(C)=O

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