CHEBI:58530 - gentamycin C_1a(5+)

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ChEBI Name gentamycin C1a(5+) ChEBI ID CHEBI:58530 ChEBI ASCII Name gentamycin C1a(5+) Definition Pentacation of gentamycin C1a. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C19H44N5O7 Net Charge +5 Average Mass 454.58200 Monoisotopic Mass 454.32133 InChI InChI=1S/C19H39N5O7/c1-19(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/h8-18,24-27H,3-7,20-23H2,1-2H3/p+5/t8-,9+,10-,11+,12-,13+,14+,15-,16+,17+,18+,19-/m0/s1 InChIKey VEGXETMJINRLTH-BOZYPMBZSA-S SMILES C[NH2+][C@@H]1[C@@H](O)[C@H](OC[C@]1(C)O)O[C@H]1[C@H]([NH3+])C[C@H]([NH3+])[C@@H](O[C@H]2O[C@H](C[NH3+])CC[C@H]2[NH3+])[C@@H]1O ChEBI Ontology Outgoing gentamycin C1a(5+) (CHEBI:58530) is a ammonium ion derivative (CHEBI:35274) gentamycin C1a(5+) (CHEBI:58530) is conjugate acid of gentamycin C1a (CHEBI:27784) Incoming gentamycin C1a (CHEBI:27784) is conjugate base of gentamycin C1a(5+) (CHEBI:58530) IUPAC Name (1R,2S,3S,4R,6S)-4,6-diammmonio-3-[3-deoxy-4-C-methyl-3-(methylammonio)-β-L-arabinopyranosyloxy]-2-hydroxycyclohexyl 2,6-diamino-2,3,4,6-tetradeoxy-α-D-erythro-hexopyranoside Synonym Source gentamicin C1a UniProt Last Modified 13 November 2017