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CHEBI:222624 - Griseolic acid

ChEBI IDCHEBI:222624
ChEBI NameGriseolic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H13N5O8
Net Charge0
Average Mass379.285
Monoisotopic Mass379.07641
SMILESNc1ncnc2c1ncn2[C@@H]1OC2=C[C@](C(=O)O)([C@H](O)C(=O)O)O[C@@H]2[C@H]1O
InChIInChI=1S/C14H13N5O8/c15-9-5-10(17-2-16-9)19(3-18-5)11-6(20)7-4(26-11)1-14(27-7,13(24)25)8(21)12(22)23/h1-3,6-8,11,20-21H,(H,22,23)(H,24,25)(H2,15,16,17)/t6-,7+,8-,11-,14-/m1/s1
InChIKeyIAPZXUKYTCQQFE-FTRAOVNNSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (2993219)
ChEBI Ontology
Outgoing Relation(s)
Griseolic acid (CHEBI:222624) is a 6-aminopurines (CHEBI:20706)
IUPAC Name 
(2R,3R,3aR,5R)-2-(6-aminopurin-9-yl)-5-[(S)-carboxy(hydroxy)methyl]-3-hydroxy-3,3a-dihydro-2H-uro[3,2-b]uran-5-carboxylic acid
Manual XrefsDatabases
78443024ChemSpider