Gentamicin C1a; 6',6'-N-Di-Me 

AlkaPlorer ID: AK062336

Synonym: Antibiotic XK 62-4, XK 62-4

IUPAC Name: 2-[4,6-diamino-3-[3-amino-6-[(dimethylamino)methyl]oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-5-methyl-4-(methylamino)oxane-3,5-diol

Structure

SMILES: CNC1C(O)C(OC2C(N)CC(N)C(OC3OC(CN(C)C)CCC3N)C2O)OCC1(C)O

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InChI: InChI=1S/C21H43N5O7/c1-21(29)9-30-20(15(28)18(21)25-2)33-17-13(24)7-12(23)16(14(17)27)32-19-11(22)6-5-10(31-19)8-26(3)4/h10-20,25,27-29H,5-9,22-24H2,1-4H3

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InChIKey: JIKGJIHKYFTHPO-UHFFFAOYSA-N

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Reference

PubChem CID: 3052876

CAS: 69375-06-0

COCONUT: CNP0336568

Properties Information

Molecule Weight: 477.6030000000003

TPSA: 190.94

MolLogP: -3.373799999999992

Number of H-Donors: 7

Number of H-Acceptors: 12

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information