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CHEBI:46496 - [(1R,4S,6S)-4-(6-AMINO-9H-PURIN-9-YL)-6-HYDROXYCYCLOHEX-2-EN-1-YL]METHYL DIHYDROGEN PHOSPHATE

Default Structure
ChEBI IDCHEBI:46496
ChEBI Name[(1R,4S,6S)-4-(6-AMINO-9H-PURIN-9-YL)-6-HYDROXYCYCLOHEX-2-EN-1-YL]METHYL DIHYDROGEN PHOSPHATE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC12H16N5O5P
Net Charge0
Average Mass341.264
Monoisotopic Mass341.08891
SMILES[H]O[C@@]1([H])C([H])([H])[C@]([H])(n2c([H])nc3c(N([H])[H])nc([H])nc32)C([H])=C([H])[C@]1([H])C([H])([H])OP(=O)(O[H])O[H]
InChIInChI=1S/C12H16N5O5P/c13-11-10-12(15-5-14-11)17(6-16-10)8-2-1-7(9(18)3-8)4-22-23(19,20)21/h1-2,5-9,18H,3-4H2,(H2,13,14,15)(H2,19,20,21)/t7-,8-,9+/m1/s1
InChIKeyCZNHTUYPRVHNIW-HLTSFMKQSA-N
ChEBI Ontology
Outgoing Relation(s)
[(1R,4S,6S)-4-(6-AMINO-9H-PURIN-9-YL)-6-HYDROXYCYCLOHEX-2-EN-1-YL]METHYL DIHYDROGEN PHOSPHATE (CHEBI:46496) is a unclassifieds (CHEBI:27189)
Synonyms  Source
[(1R,4S,6S)-4-(6-amino-9H-purin-9-yl)-6-hydroxycyclohex-2-en-1-yl]methyl dihydrogen phosphatePDBeChem
[(1R,4S,6S)-4-(6-AMINO-9H-PURIN-9-YL)-6-HYDROXYCYCLOHEX-2-EN-1-YL]METHYL DIHYDROGEN PHOSPHATEPDBeChem
Manual XrefsDatabases
XARPDBeChem