EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

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

ChEBI IDCHEBI:59924
ChEBI Name5,6,7,8-tetrahydrosarcinapterin(4−)
Stars
ASCII Name5,6,7,8-tetrahydrosarcinapterin(4-)
DefinitionA tricarboxylic acid anion obtained by deprotonation of the carboxy and phosphate groups of 5,6,7,8-tetrahydrosarcinapterin; major species at pH 7.3.
Last Modified23 March 2012
SubmitterAnne Morgat
DownloadsMolfile
FormulaC35H48N7O19P
Net Charge-4
Average Mass901.773
Monoisotopic Mass901.27645
SMILES[H][C@@]1([C@@H](C)Nc2ccc(C[C@H](O)[C@H](O)[C@H](O)CO[C@H]3O[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]3O)cc2)Nc2c(nc(N)nc2=O)N[C@H]1C
InChIInChI=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
InChIKeyDOMRFGVDYQUXCH-HXBMNFMZSA-J
ChEBI Ontology
Outgoing Relation(s)
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 Relation(s)
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
Synonym  Source
5,6,7,8-tetrahydrosarcinapterin tetraanionChEBI
UniProt Name  Source
5,6,7,8-tetrahydrosarcinapterinUniProt