CHEBI:222624 - Griseolic acid

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Griseolic acid
ChEBI ID CHEBI:222624
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H13N5O8
Net Charge 0
Average Mass 379.285
Monoisotopic Mass 379.07641
InChI InChI=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
InChIKey IAPZXUKYTCQQFE-FTRAOVNNSA-N
SMILES O=C(O)[C@]1(O[C@@H]2[C@@H](O)[C@H](N3C4=NC=NC(=C4N=C3)N)OC2=C1)[C@H](O)C(=O)O
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing 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 Xref Database
78443024 ChemSpider
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