CHEBI:211916 - Lemonomycin

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Lemonomycin
ChEBI ID CHEBI:211916
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C27H41N3O9
Net Charge 0
Average Mass 551.637
Monoisotopic Mass 551.28428
InChI InChI=1S/C27H41N3O9/c1-11-21(31)13-8-16-20-14(26(34)35)7-15(28-20)25(33)30(16)17(19(13)22(32)23(11)37-6)10-38-18-9-27(3,36)24(29(4)5)12(2)39-18/h12,14-18,20,24-26,28,33-36H,7-10H2,1-6H3/t12-,14+,15-,16-,17-,18+,20+,24+,25-,27-/m0/s1
InChIKey JXWCEWIDCYAQRW-RNWDBXQFSA-N
SMILES O=C1C(OC)=C(C(=O)C2=C1[C@@H](N3[C@@H](O)[C@@H]4C[C@H]([C@H]([C@@H]3C2)N4)C(O)O)CO[C@@H]5O[C@H]([C@@H](N(C)C)[C@](C5)(O)C)C)C
Metabolite of Species Details
Streptomyces candidus (NCBI:txid67283) See: DOI
ChEBI Ontology
Outgoing Lemonomycin (CHEBI:211916) is a aminoglycoside (CHEBI:47779)
IUPAC Name
(1R,2S,10R,12S,13S,15R)-15-(dihydroxymethyl)-10-[[(2R,4S,5R,6S)-5-(dimethylamino)-4-hydroxy-4,6-dimethyloxan-2-yl]oxymethyl]-12-hydroxy-7-methoxy-6-methyl-11,16-diazatetracyclo[11.2.1.02,11.04,9]hexadeca-4(9),6-diene-5,8-dione
Manual Xref Database
8730105 ChemSpider
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