CHEBI:205781 - 3′-N-methyl-medermycin

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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 3′-N-methyl-medermycin
ChEBI ID CHEBI:205781
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C23H25NO8
Net Charge 0
Average Mass 443.452
Monoisotopic Mass 443.15802
InChI InChI=1S/C23H25NO8/c1-8-16-18(23-14(30-8)7-15(25)32-23)21(28)11-5-4-10(20(27)17(11)22(16)29)13-6-12(24-3)19(26)9(2)31-13/h4-5,8-9,12-14,19,23-24,26-27H,6-7H2,1-3H3/t8-,9-,12-,13-,14-,19-,23+/m1/s1
InChIKey NVDVGEYHDRXWNO-LWRGVASRSA-N
SMILES O=C1C2=C(O)C(=CC=C2C(=O)C3=C1[C@H](O[C@H]4[C@@H]3OC(=O)C4)C)[C@@H]5O[C@@H]([C@@H](O)[C@@H](C5)NC)C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
Roles Classification
Biological Role(s): antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
(via heterocyclic antibiotic )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 3′-N-methyl-medermycin (CHEBI:205781) is a benzoisochromanequinone (CHEBI:48129)
IUPAC Name
(11R,15R,17R)-4-hydroxy-5-[(2R,4R,5S,6R)-5-hydroxy-6-methyl-4-(methylamino)oxan-2-yl]-17-methyl-12,16-dioxatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),3(8),4,6-tetraene-2,9,13-trione