CHEBI:77354 - novamethymycin(1+)

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ChEBI Name novamethymycin(1+) ChEBI ID CHEBI:77354 Definition An organic cation that is the conjugate acid of novamethymycin, obtained by protonation of the tertiary amino group; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter KAX 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 C25H44NO8 Net Charge +1 Average Mass 486.61820 Monoisotopic Mass 486.30614 InChI InChI=1S/C25H43NO8/c1-13-11-14(2)21(33-24-20(29)18(26(7)8)12-15(3)32-24)16(4)23(30)34-22(17(5)27)25(6,31)10-9-19(13)28/h9-10,13-18,20-22,24,27,29,31H,11-12H2,1-8H3/p+1/b10-9+/t13-,14+,15-,16-,17-,18+,20-,21+,22-,24+,25+/m1/s1 InChIKey HYJMTIGQCJGKFQ-CGNAQTDSSA-O SMILES C[C@@H](O)[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)[NH+](C)C)[C@@H](C)C[C@@H](C)C(=O)\C=C\[C@]1(C)O ChEBI Ontology Outgoing novamethymycin(1+) (CHEBI:77354) is a ammonium ion derivative (CHEBI:35274) novamethymycin(1+) (CHEBI:77354) is a organic cation (CHEBI:25697) novamethymycin(1+) (CHEBI:77354) is conjugate acid of novamethymycin (CHEBI:77652) Incoming novamethymycin (CHEBI:77652) is conjugate base of novamethymycin(1+) (CHEBI:77354) IUPAC Name (3R,4S,5S,7R,9E,11R,12S)-11-hydroxy-12-[(1R)-1-hydroxyethyl]-3,5,7,11-tetramethyl-2,8-dioxooxacyclododec-9-en-4-yl 3,4,6-trideoxy-3-(dimethylazaniumyl)-β-D-xylo-hexopyranoside Synonym Source novamethymycin UniProt Manual Xref Database CPD-15998 MetaCyc View more database links Citation Type Source 11720530 PubMed citation SUBMITTER Last Modified 11 March 2014