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Chemistry

Mol. Mass

1390.73

ALogP

Missing data

Rule of 5

Missing data

Rule of 3

Missing data
Details
  • SMILES: CNC(C)[C@@H]1CC[C@@H](N)[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[C@H]3OC[C@](C)(O)[C@H](NC)[C@H]3O)[C@H]2O)O1.CN[C@@H]4[C@@H](O)[C@@H](O[C@H]5[C@H](N)C[C@H](N)[C@@H](O[C@H]6O[C@H](CN)CC[C@H]6N)[C@@H]5O)OC[C@]4(C)O.CN[C@@H]7[C@@H](O)[C@@H](O[C@H]8[C@H](N)C[C@H](N)[C@@H](O[C@H]9O[C@@H](CC[C@H]9N)C(C)N)[C@@H]8O)OC[C@]7(C)O
  • InChIKey: NPEFREDMMVQEPL-RWPARATISA-N
    InChI=1S/C21H43N5O7.C20H41N5O7.C19H39N5O7/c1-9(25-3)13-6-5-10(22)19(31-13)32-16-11(23)7-12(24)17(14(16)27)33-20-15(28)18(26-4)21(2,29)8-30-20;1-8(21)12-5-4-9(22)18(30-12)31-15-10(23)6-11(24)16(13(15)26)32-19-14(27)17(25-3)20(2,28)7-29-19;1-19(27)7-28-18(13(26)16(19)24-2)31-15-11(23)5-10(22)14(12(15)25)30-17-9(21)4-3-8(6-20)29-17/h9-20,25-29H,5-8,22-24H2,1-4H3;8-19,25-28H,4-7,21-24H2,1-3H3;8-18,24-27H,3-7,20-23H2,1-2H3/t9?,10-,11+,12-,13+,14+,15-,16-,17+,18-,19-,20-,21+;8?,9-,10+,11-,12+,13+,14-,15-,16+,17-,18-,19-,20+;8-,9+,10-,11+,12-,13+,14+,15-,16+,17+,18+,19-/m110/s1
  • Chirality: None
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3039597   ChEMBL
gentamicin *

CHEMBL3039594   ChEMBL
gentamicin sulfate

3P99H114B8   NCATS
gentamicin c2 *

8X7386QRLV   NCATS
gentamicin sulfate

Gentamicin   Wikipedia

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