CHEBI:206294 - Napyradiomycin 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 Napyradiomycin B
ChEBI ID CHEBI:206294
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C24H26O7
Net Charge 0
Average Mass 426.465
Monoisotopic Mass 426.16785
InChI InChI=1S/C24H26O7/c1-12-4-5-13(11-25)8-14-17(26)9-15-19(20(14)28)21(29)16-10-18(27)23(2,3)31-24(16,7-6-12)22(15)30/h5-6,9-10,18,25-28H,4,7-8,11H2,1-3H3/b12-6-,13-5+/t18-,24+/m0/s1
InChIKey HFBASMIVABLIAD-PWVVRUMISA-N
SMILES O=C1C2=C(O)C3=C(O)C=C2C(=O)[C@]4(C1=C[C@H](O)C(C)(C)O4)CC=C(CC=C(C3)CO)C
Metabolite of Species Details
Streptomycesspecies (NCBI:txid1931) See: PubMed
ChEBI Ontology
Outgoing Napyradiomycin B (CHEBI:206294) is a organic heterotricyclic compound (CHEBI:26979)
Napyradiomycin B (CHEBI:206294) is a organooxygen compound (CHEBI:36963)
IUPAC Name
(1R,3E,6E,17S)-10,17,21-trihydroxy-7-(hydroxymethyl)-4,18,18-trimethyl-19-oxatetracyclo[10.7.1.19,13.01,15]henicosa-3,6,9,11,13(21),15-hexaene-14,20-dione
Manual Xref Database
78437312 ChemSpider
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