CHEBI:71997 - rifamycin-undecaketide carboxylic acid

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ChEBI Name rifamycin-undecaketide carboxylic acid ChEBI ID CHEBI:71997 Definition A hydroxy monocarboxylic acid that is an intermediate in the biosynthesis of rifamycin. Stars This entity has been manually annotated by the ChEBI Team. 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 C35H47NO10 Net Charge 0 Average Mass 641.74840 Monoisotopic Mass 641.32000 InChI InChI=1S/C35H47NO10/c1-15(10-9-11-16(2)35(45)46)28(38)20(6)32(42)22(8)33(43)21(7)29(39)17(3)12-18(4)30(40)27-26-23(13-19(5)31(27)41)34(44)24(36)14-25(26)37/h9-15,17,20-22,28-29,32-33,38-39,41-43H,36H2,1-8H3,(H,45,46)/b10-9+,16-11+,18-12+/t15-,17?,20+,21+,22+,28-,29-,32+,33+/m0/s1 InChIKey NXTXEEVRCXWODD-KTFCZHAFSA-N SMILES C[C@@H](\C=C\C=C(/C)C(O)=O)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)C(C)\C=C(/C)C(=O)c1c(O)c(C)cc2C(=O)C(N)=CC(=O)c12 Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) Biological Role(s): bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria. View more via ChEBI Ontology ChEBI Ontology Outgoing rifamycin-undecaketide carboxylic acid (CHEBI:71997) has role bacterial metabolite (CHEBI:76969) rifamycin-undecaketide carboxylic acid (CHEBI:71997) is a hydroxy monocarboxylic acid (CHEBI:35868) rifamycin-undecaketide carboxylic acid (CHEBI:71997) is a hydroxy-1,4-naphthoquinone (CHEBI:132157) rifamycin-undecaketide carboxylic acid (CHEBI:71997) is a polyketide (CHEBI:26188) Incoming rifamycin-undecaketide carboxy group (CHEBI:71996) is substituent group from rifamycin-undecaketide carboxylic acid (CHEBI:71997) IUPAC Name (2E,4E,6S,7S,8R,9R,10R,11R,12R,13S,15E)-17-(6-amino-2,4-dihydroxy-3-methyl-5,8-dioxo-3,4,5,8-tetrahydronaphthalen-1-yl)-7,9,11,13-tetrahydroxy-2,6,8,10,12,14,16-heptamethyl-17-oxoheptadeca-2,4,15-trienoic acid Citations Types Sources 10430893 PubMed citation Europe PMC 10627035 PubMed citation Europe PMC Last Modified 09 June 2016