Ristomycin A aglycone, 41-((4-((4-butylphenyl)methyl)-1-piperazinyl)methyl)- 56-O-(2-amino-2-deoxy-betaD-glucopyranuronosyl)-5,31-dichloro-7-demethyl-64-O-demethyl-19-deoxy-N15-methyl-

化合物标识与属性

CAS

562105-20-8

PubChem CID

135802337

SMILES

CCCCC1=CC=C(C=C1)CN2CCN(CC2)CC3=C(C=C4[C@H](NC(=O)[C@@H]5[C@@H](C6=CC(=C(C=C6)OC7=CC8=CC(=C7O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)C(=O)O)O)O)N)OC1=CC=C(C[C@@H]2C(=O)N[C@@H](C6=C(C(=CC(=C6)OC6=C(C=CC(=C6)[C@@H](C(=O)N2)NC)O)O)Cl)C(=O)N[C@H]8C(=O)N[C@H](C2=CC(=C(C=C2)O)C4=C3O)C(=O)N5)C=C1)Cl)O)C(=O)O)O

Canonical SMILES

CCCCc1ccc(CN2CCN(Cc3c(O)cc4c(c3O)-c3cc(ccc3O)[C@H]3NC(=O)[C@@H]5NC(=O)[C@H]6NC(=O)[C@@H](Cc7ccc(cc7)Oc7cc5cc(c7O[C@@H]5O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]5N)Oc5ccc(cc5Cl)[C@@H](O)[C@H](NC3=O)C(=O)N[C@@H]4C(=O)O)NC(=O)[C@@H](NC)c3ccc(O)c(c3)Oc3cc(O)c(Cl)c6c3)CC2)cc1