Not named

AlkaPlorer ID: AK029207

Synonym: 'Istamycin A2'

IUPAC Name: N-[(1S,2R,3R,4S,6S)-4-amino-3-[(2R,3R,6S)-3-amino-6-(methylaminomethyl)oxan-2-yl]oxy-2-hydroxy-6-methoxycyclohexyl]-2-(carbamoylamino)-N-methylacetamide

Structure

SMILES: CNC[C@@H]1CC[C@@H](N)[C@@H](O[C@H]2[C@H](O)[C@H](N(C)C(=O)CNC(=N)O)[C@@H](OC)C[C@@H]2N)O1

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InChI: InChI=1S/C18H36N6O6/c1-22-7-9-4-5-10(19)17(29-9)30-16-11(20)6-12(28-3)14(15(16)26)24(2)13(25)8-23-18(21)27/h9-12,14-17,22,26H,4-8,19-20H2,1-3H3,(H3,21,23,27)/t9-,10+,11-,12-,14+,15+,16+,17+/m0/s1

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InChIKey: BBWHQSZBCQYJHR-JWYRXTSNSA-N

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Properties Information

Molecule Weight: 432.5220000000002

TPSA: 188.41

MolLogP: -2.560329999999992

Number of H-Donors: 7

Number of H-Acceptors: 9

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information