CHEBI:215090 - (+/-)-oxanthromicin G

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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 (+/-)-oxanthromicin G
ChEBI ID CHEBI:215090
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C31H24O9
Net Charge 0
Average Mass 540.524
Monoisotopic Mass 540.14203
InChI InChI=1S/C31H24O9/c1-11-6-7-16-26(27(11)36)29(38)24-13(3)25(30(39)40)21(35)9-17(24)31(16,5)18-10-20(34)23-12(2)22(14(4)32)19(33)8-15(23)28(18)37/h6-10,33,35-36H,1-5H3,(H,39,40)/t31-/m0/s1
InChIKey VBWHIMQOJAFUAX-HKBQPEDESA-N
SMILES O=C1C2=C(O)C(=CC=C2[C@@](C=3C(=O)C4=C(C(=C(C(=O)C)C(=C4)O)C)C(C3)=O)(C)C5=C1C(=C(C(=O)O)C(=C5)O)C)C
Metabolite of Species Details
Actinomadura (NCBI:txid1988) See: DOI
ChEBI Ontology
Outgoing (+/-)-oxanthromicin G (CHEBI:215090) is a anthracenes (CHEBI:46955)
IUPAC Name
10-(6-acetyl-7-hydroxy-5-methyl-1,4-dioxonaphthalen-2-yl)-3,8-dihydroxy-1,7,10-trimethyl-9-oxoanthracene-2-carboxylic acid