CHEBI:16368 - 6-hydroxymellein

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ChEBI Name 6-hydroxymellein ChEBI ID CHEBI:16368 Definition An isochromane that is mellein bearing an additional hydroxy substituent at the 6-position. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:12218, CHEBI:20730, CHEBI:2199 Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C10H10O4 Net Charge 0 Average Mass 194.18400 Monoisotopic Mass 194.05791 InChI InChI=1S/C10H10O4/c1-5-2-6-3-7(11)4-8(12)9(6)10(13)14-5/h3-5,11-12H,2H2,1H3/t5-/m1/s1 InChIKey DHLPMLVSBRRUGA-RXMQYKEDSA-N SMILES [H][C@@]1(C)Cc2cc(O)cc(O)c2C(=O)O1 ChEBI Ontology Outgoing 6-hydroxymellein (CHEBI:16368) has functional parent mellein (CHEBI:38760) 6-hydroxymellein (CHEBI:16368) is a isochromanes (CHEBI:38762) IUPAC Name (3R)-6,8-dihydroxy-3-methyl-3,4-dihydro-1H-isochromen-1-one Synonyms Sources (−)-6-hydroxymellein ChEBI (3R)-3,4-dihydro-6,8-dihydroxy-3-methyl-isocoumarin ChEBI (R)-(−)-6-hydroxymellein ChEBI (R)-3,4-dihydro-6,8-dihydroxy-3-methyl-1H-2-benzopyran-1-one ChemIDplus (R)-6-hydroxymellein ChEBI 3,4-Dihydro-6,8-dihydroxy-3-methylisocoumarin ChemIDplus 6,8-Dihydroxy-3-methyl-3,4-dihydroisocoumarin ChemIDplus 6-Hydroxymellein KEGG COMPOUND 6-hydroxymellein UniProt Manual Xrefs Databases C00000554 KNApSAcK C02379 KEGG COMPOUND View more database links Registry Numbers Types Sources 3544385 Reaxys Registry Number Reaxys 70901-60-9 CAS Registry Number ChemIDplus Citation Type Source 7706125 PubMed citation Europe PMC Last Modified 13 November 2017