CHEBI:59924 - 5,6,7,8-tetrahydrosarcinapterin(4−)

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ChEBI Name 5,6,7,8-tetrahydrosarcinapterin(4−)
ChEBI ID CHEBI:59924
ChEBI ASCII Name 5,6,7,8-tetrahydrosarcinapterin(4-)
Definition A tricarboxylic acid anion obtained by deprotonation of the carboxy and phosphate groups of 5,6,7,8-tetrahydrosarcinapterin; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Anne Morgat
Supplier Information
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Formula C35H48N7O19P
Net Charge -4
Average Mass 901.76490
Monoisotopic Mass 901.27645
InChI InChI=1S/C35H52N7O19P/c1-14(25-15(2)38-30-26(40-25)32(53)42-35(36)41-30)37-17-5-3-16(4-6-17)11-19(43)27(49)20(44)12-58-34-29(51)28(50)22(60-34)13-59-62(56,57)61-21(8-10-24(47)48)31(52)39-18(33(54)55)7-9-23(45)46/h3-6,14-15,18-22,25,27-29,34,37,40,43-44,49-51H,7-13H2,1-2H3,(H,39,52)(H,45,46)(H,47,48)(H,54,55)(H,56,57)(H4,36,38,41,42,53)/p-4/t14-,15+,18+,19+,20-,21+,22-,25+,27+,28-,29-,34+/m1/s1
InChIKey DOMRFGVDYQUXCH-HXBMNFMZSA-J
SMILES [H][C@]1(Nc2c(N[C@H]1C)nc(N)[nH]c2=O)[C@@H](C)Nc1ccc(C[C@H](O)[C@H](O)[C@H](O)CO[C@H]2O[C@H](COP([O-])(=O)O[C@@H](CCC([O-])=O)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O)[C@@H](O)[C@H]2O)cc1
ChEBI Ontology
Outgoing 5,6,7,8-tetrahydrosarcinapterin(4−) (CHEBI:59924) is a organophosphate oxoanion (CHEBI:58945)
5,6,7,8-tetrahydrosarcinapterin(4−) (CHEBI:59924) is a tricarboxylic acid anion (CHEBI:35753)
5,6,7,8-tetrahydrosarcinapterin(4−) (CHEBI:59924) is conjugate base of 5,6,7,8-tetrahydrosarcinapterin (CHEBI:59345)
Incoming 5,6,7,8-tetrahydrosarcinapterin (CHEBI:59345) is conjugate acid of 5,6,7,8-tetrahydrosarcinapterin(4−) (CHEBI:59924)
IUPAC Name
1-[4-({(1R)-1-[(6S,7S)-2-amino-7-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]ethyl}amino)phenyl]-5-O-[5-O-({[(2S)-4-carboxylato-1-{[(1S)-1,3-dicarboxylatopropyl]amino}-1-oxobutan-2-yl]oxy}phosphinato)-α-DD-ribofuranosyl]-1-deoxy-D-ribitol
Synonyms Sources
5,6,7,8-tetrahydrosarcinapterin UniProt
5,6,7,8-tetrahydrosarcinapterin tetraanion ChEBI
Last Modified
23 March 2012