CHEBI:218077 - Geomycin 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 Geomycin C
ChEBI ID CHEBI:218077
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C34H28O14
Net Charge 0
Average Mass 660.584
Monoisotopic Mass 660.14791
InChI InChI=1S/C34H28O14/c1-15-7-21(37)27(22(8-15)46-29-19(31(39)44-5)11-17(35)13-25(29)42-3)33(41)47-23-9-16(2)10-24-28(23)30(38)34(48-24)20(32(40)45-6)12-18(36)14-26(34)43-4/h7-14,35,37H,1-6H3/t34-/m1/s1
InChIKey GNHQZFDQZNRWBS-UUWRZZSWSA-N
SMILES O=C1C=C(OC)[C@]2(OC=3C=C(C)C=C(C3C2=O)OC(=O)C4=C(OC5=C(OC)C=C(O)C=C5C(=O)OC)C=C(C)C=C4O)C(=C1)C(=O)OC
Metabolite of Species Details
Geomycesspecies (NCBI:txid1715258) See: PubMed
ChEBI Ontology
Outgoing Geomycin C (CHEBI:218077) is a aromatic ether (CHEBI:35618)
IUPAC Name
methyl (2R)-4-[2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoyl]oxy-5'-methoxy-6-methyl-3,3'-dioxospiro[1-benzouran-2,6'-cyclohexa-1,4-diene]-1'-carboxylate
Manual Xref Database
24712973 ChemSpider
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