CHEBI:205612 - Bacillosporin C

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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 Bacillosporin C
ChEBI ID CHEBI:205612
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C26H18O10
Net Charge 0
Average Mass 490.420
Monoisotopic Mass 490.09000
InChI InChI=1S/C26H18O10/c1-8-3-12(28)18-19-14(8)13(29)5-26(33)25(19,7-35-24(18)32)20-21(30)10-6-34-23(31)17-11(27)4-9(2)15(16(10)17)22(20)36-26/h3-4,27-28,30,33H,5-7H2,1-2H3/t25-,26-/m0/s1
InChIKey KHBPWHLZTSXJPH-UIOOFZCWSA-N
SMILES O=C1OCC=2C(O)=C3[C@@]45C6=C(C(=O)OC4)C(O)=CC(=C6C(C[C@@]5(OC3=C7C2C1=C(O)C=C7C)O)=O)C
Metabolite of Species Details
Talaromyces purpureogenus (NCBI:txid1266744) See: DOI
ChEBI Ontology
Outgoing Bacillosporin C (CHEBI:205612) is a naphthofuran (CHEBI:39270)
IUPAC Name
(1S,15S)-3,9,15,21-tetrahydroxy-11,19-dimethyl-6,14,24-trioxaheptacyclo[16.7.1.14,8.01,15.02,13.022,26.012,27]heptacosa-2,4(27),8,10,12,18(26),19,21-octaene-7,17,23-trione
Manual Xref Database
68004043 ChemSpider
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