CHEBI:197906 - Myxovirescin A1

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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 Myxovirescin A1
ChEBI ID CHEBI:197906
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C35H61NO8
Net Charge 0
Average Mass 623.872
Monoisotopic Mass 623.43972
InChI InChI=1S/C35H61NO8/c1-6-12-33-34(41)36-23-30(38)22-32(40)31(39)20-19-28(24-43-5)16-10-14-27(7-2)15-11-18-29(37)17-9-8-13-25(3)21-26(4)35(42)44-33/h10,14,16,25-27,30-33,38-40H,6-9,11-13,15,17-24H2,1-5H3,(H,36,41)/b14-10+,28-16-/t25-,26+,27?,30+,31-,32+,33+/m1/s1
InChIKey VQWNGCSUNKJFLW-ARNOELBJSA-N
SMILES O=C1O[C@H](C(=O)NC[C@@H](O)C[C@H](O)[C@H](O)CCC(=CC=CC(CCCC(CCCC[C@H](C[C@@H]1C)C)=O)CC)COC)CCC
Metabolite of Species Details
Myxococcus (NCBI:txid32) See: DOI
ChEBI Ontology
Outgoing Myxovirescin A1 (CHEBI:197906) is a lactam (CHEBI:24995)
Myxovirescin A1 (CHEBI:197906) is a macrolide (CHEBI:25106)
IUPAC Name
(2S,6S,8S,9R,12Z,14E,25R,27S)-16-ethyl-6,8,9-trihydroxy-12-(methoxymethyl)-25,27-dimethyl-2-propyl-1-oxa-4-azacyclooctacosa-12,14-diene-3,20,28-trione
Manual Xref Database
8614334 ChemSpider
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