amino-[4-[2-[(4-butylphenyl)methylamino]acetyl]piperazine-1-carbonyl]-dichloro-heptahydroxy-[?]hexone

化合物标识与属性

PubChem CID

16133739

SMILES

CCCCC1=CC=C(C=C1)CNCC(=O)N2CCN(CC2)C(=O)[C@@H]3C4=C(C(=CC(=C4)O)O)C5=C(C=CC(=C5)[C@@H]6C(=O)N[C@@H]([C@@H](C7=CC(=C(C=C7)OC8=CC9=CC(=C8O)OC1=C(C=C(C[C@@H]2C(=O)N[C@@H](C4=CC(=CC(=C4)OC4=C(C=CC(=C4)[C@H](C(=O)N2)N)O)O)C(=O)N[C@H]9C(=O)N6)C=C1)Cl)Cl)O)C(=O)N3)O

Canonical SMILES

CCCCc1ccc(CNCC(=O)N2CCN(C(=O)[C@H]3NC(=O)[C@H]4NC(=O)[C@H](NC(=O)[C@@H]5NC(=O)[C@H]6NC(=O)[C@@H](Cc7ccc(c(Cl)c7)Oc7cc5cc(c7O)Oc5ccc(cc5Cl)[C@H]4O)NC(=O)[C@H](N)c4ccc(O)c(c4)Oc4cc(O)cc6c4)c4ccc(O)c(c4)-c4c(O)cc(O)cc43)CC2)cc1