1-[(1S,2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)bicyclo[3.1.0]hexan-2-yl]thymineImported
A carbobicyclic compound that is bicyclo[3.1.0]hexane which is substituted at the 2-pro-S, 4-pro-S and 5-pro-R positions by thymin-1-yl, hydroxy, and hydroxymethyl groups, respectively.
Defined bychebi
Exact Synonyms
1-[(1S,2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)bicyclo[3.1.0]hex-2-yl]-5-methylpyrimidine-2,4(1H,3H)-dione
Related Synonyms
1-[(1'S,2'S,4'S,5'R)-4'-hydroxy-5'-(hydroxymethyl)bicyclo[3.1.0]hexan-2'-yl]-5-methylpyrimidine-2,4(1H,3H)-dione
1-[4-HYDROXY-5-(HYDROXYMETHYL)BICYCLO[3.1.0]HEX-2-YL]-5-METHYLPYRIMIDINE-2,4(1H,3H)-DIONE
north-methanocarbathymidine
- chemical entitychebi (200,444)
- molecular entitychebi (196,129)
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- diazineschebi (1,794)
- pyrimidineschebi (1,349)
- diazineschebi (1,794)
- organonitrogen heterocyclic compoundchebi (35,353)
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- pyrimidineschebi (1,349)
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- C-glycosyl compoundchebi (2,262)
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- pnictogen molecular entitychebi (88,874)
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- pyrimidineschebi (1,349)
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- organonitrogen heterocyclic compoundchebi (35,353)
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- pyrimidineschebi (1,349)
- diazineschebi (1,794)
- organic heteromonocyclic compoundchebi (13,701)
- carbocyclic compoundchebi (15,439)
- organic cyclic compoundchebi (84,676)
- cyclic compoundchebi (85,378)
- heteroatomic molecular entitychebi (60,413)
- main group molecular entitychebi (194,229)
- molecular entitychebi (196,129)
class Information
charge
0
formula
C12H16N2O4
has_dbxref
- PDBeChem:TMC
- PMID:16304159
- PMID:20625519
- Reaxys:6811572
has_obo_namespace
chebi_ontology
inchi
InChI=1S/C12H16N2O4/c1-6-4-14(11(18)13-10(6)17)8-2-9(16)12(5-15)3-7(8)12/h4,7-9,15-16H,2-3,5H2,1H3,(H,13,17,18)/t7-,8+,9+,12+/m1/s1
inchikey
NOWRLNPOENZFHP-ARHDFHRDSA-N
in_subset
mass
252.26640
monoisotopicmass
252.11101
smiles
[H][C@]12C[C@@]1(CO)[C@@H](O)C[C@@H]2n1cc(C)c(=O)[nH]c1=O