CHEBI:213772 - Azinomycin A

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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 Azinomycin A
ChEBI ID CHEBI:213772
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C30H33N3O10
Net Charge 0
Average Mass 595.605
Monoisotopic Mass 595.21659
InChI InChI=1S/C30H33N3O10/c1-14-7-6-8-18-19(14)9-17(40-5)10-20(18)29(39)43-26(30(4)13-41-30)28(38)32-22(27(37)31-11-15(2)34)23-25(42-16(3)35)24(36)21-12-33(21)23/h6-10,21,24-26,36H,11-13H2,1-5H3,(H,31,37)(H,32,38)/b23-22+/t21-,24+,25+,26?,30?,33?/m0/s1
InChIKey PBRHVAKBKPQZAF-IZJAFUGUSA-N
SMILES O=C(OC(C(=O)N/C(=C\1/N2[C@@H](C2)[C@H]([C@@H]1OC(=O)C)O)/C(=O)NCC(=O)C)C3(OC3)C)C=4C=5C(=C(C=CC5)C)C=C(C4)OC
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing Azinomycin A (CHEBI:213772) is a carbonyl compound (CHEBI:36586)
Azinomycin A (CHEBI:213772) is a naphthalenes (CHEBI:25477)
IUPAC Name
[2-[[(1E)-1-[(3R,4R,5S)-3-acetyloxy-4-hydroxy-1-azabicyclo[3.1.0]hexan-2-ylidene]-2-oxo-2-(2-oxopropylamino)ethyl]amino]-1-(2-methyloxiran-2-yl)-2-oxoethyl] 3-methoxy-5-methylnaphthalene-1-carboxylate
Manual Xref Database
9932912 ChemSpider
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