CHEBI:216406 - Retipolide A

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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 Retipolide A
ChEBI ID CHEBI:216406
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C26H20O9
Net Charge 0
Average Mass 476.437
Monoisotopic Mass 476.11073
InChI InChI=1S/C26H20O9/c27-17-7-3-13-9-10-32-25(31)26(12-14-1-4-15(5-2-14)33-19(17)11-13)21-16-6-8-18(28)20(16)23(29)34-22(21)24(30)35-26/h1-5,7,11,23,27,29H,6,8-10,12H2/t23?,26-/m1/s1
InChIKey YQMDXACDZZDJBU-ANWICMFUSA-N
SMILES O=C1OCCC2=CC(OC3=CC=C(C[C@]14OC(=O)C5=C4C6=C(C(=O)CC6)C(O5)O)C=C3)=C(O)C=C2
Metabolite of Species Details
Retiboletus (NCBI:txid889442) See: DOI
ChEBI Ontology
Outgoing Retipolide A (CHEBI:216406) is a macrolide (CHEBI:25106)
IUPAC Name
(12R)-4,8'-dihydroxyspiro[2,10-dioxatricyclo[12.2.2.13,7]nonadeca-1(16),3,5,7(19),14,17-hexaene-12,3'-4,7-dioxatricyclo[7.3.0.02,6]dodeca-1(9),2(6)-diene]-5',10',11-trione
Manual Xref Database
28284634 ChemSpider
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