CHEBI:75860 - (3R)-citramalyl-CoA

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ChEBI Name (3R)-citramalyl-CoA ChEBI ID CHEBI:75860 ChEBI ASCII Name (3R)-citramalyl-CoA Definition The (3R)-diastereomer of citramalyl-CoA. 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 C26H42N7O20P3S Net Charge 0 Average Mass 897.63300 Monoisotopic Mass 897.14182 InChI InChI=1S/C26H42N7O20P3S/c1-25(2,19(37)22(38)29-5-4-14(34)28-6-7-57-15(35)8-26(3,41)24(39)40)10-50-56(47,48)53-55(45,46)49-9-13-18(52-54(42,43)44)17(36)23(51-13)33-12-32-16-20(27)30-11-31-21(16)33/h11-13,17-19,23,36-37,41H,4-10H2,1-3H3,(H,28,34)(H,29,38)(H,39,40)(H,45,46)(H,47,48)(H2,27,30,31)(H2,42,43,44)/t13-,17-,18-,19+,23-,26-/m1/s1 InChIKey XYGOWHUIVNMEIA-FCVHJOHKSA-N SMILES CC(C)(COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)C[C@@](C)(O)C(O)=O Roles Classification Chemical Role(s): acyl donor Any donor that can transfer acyl groups between molecular entities. (via acyl-CoA ) View more via ChEBI Ontology ChEBI Ontology Outgoing (3R)-citramalyl-CoA (CHEBI:75860) has functional parent D-citramalic acid (CHEBI:15586) (3R)-citramalyl-CoA (CHEBI:75860) is a citramalyl-CoA (CHEBI:15457) (3R)-citramalyl-CoA (CHEBI:75860) is conjugate acid of (3R)-citramalyl-CoA(5−) (CHEBI:75637) Incoming (3R)-citramalyl-CoA(5−) (CHEBI:75637) is conjugate base of (3R)-citramalyl-CoA (CHEBI:75860) IUPAC Name 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3R)-3-carboxy-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Synonyms Sources (3R)-citramalyl-coenzyme A ChEBI D-citramalyl-CoA MetaCyc Manual Xref Database CPD-9414 MetaCyc View more database links Citation Type Source 16952935 PubMed citation Europe PMC Last Modified 08 October 2013