CHEBI:216887 - Microansamycin B

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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 Microansamycin B
ChEBI ID CHEBI:216887
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H21NO5
Net Charge 0
Average Mass 319.357
Monoisotopic Mass 319.14197
InChI InChI=1S/C17H21NO5/c1-8-5-12-11(23-12)4-3-9-6-10(19)7-13-17(9,22)16(2,14(8)20)15(21)18-13/h7-9,11-12,22H,3-6H2,1-2H3,(H,18,21)/t8-,9+,11-,12-,16+,17+/m0/s1
InChIKey NSJVBGMLBQMMIK-OXOMCRHWSA-N
SMILES O=C1[C@@]2(C(=O)NC=3[C@]2(O)[C@H](CC[C@H]4[C@H](C[C@@H]1C)O4)CC(C3)=O)C
Metabolite of Species Details
Micromonosporaspecies (NCBI:txid1876) See: PubMed
ChEBI Ontology
Outgoing Microansamycin B (CHEBI:216887) is a indoles (CHEBI:24828)
IUPAC Name
(1R,4S,6S,8S,10R,17S)-17-hydroxy-8,10-dimethyl-5-oxa-12-azatetracyclo[8.6.1.04,6.013,17]heptadec-13-ene-9,11,15-trione
Manual Xref Database
78439349 ChemSpider
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