Chem
J-GLOBAL ID:200907093112167623
Nikkaji number:J81.908E
Oxetanocin A
オキセタノシンA
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C10 H13 N5 O3
Molecular formula furigana:
C10-H13-N5-O3
Molecular weight:
251.246
InChI:
InChI=1S/C10H13N5O3/c11-8-7-9(13-3-12-8)15(4-14-7)10-5(1-16)6(2-17)18-10/h3-6,10,16-17H,1-2H2,(H2,11,12,13)/t5-,6-,10-/m1/s1
InChI key:
LMJVXGOFWKVXAW-OXOINMOOSA-N
SMILES:
Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@H]1CO
Systematic name (4):
9-[(2R)-3α,4β-ジ(ヒドロキシメチル)オキセタン-2β-イル]-6-アミノ-9H-プリン
(2S)-4α-(6-アミノ-9H-プリン-9-イル)-2α,3β-オキセタンジメタノール
[(2S,3R,4R)-4-(6-アミノ-9H-プリン-9-イル)-3-(ヒドロキシメチル)オキセタン-2-イル]メタノール
[(2S,3R,4R)-4-(6-amino-9H-purin-9-yl)-3-(hydroxymethyl)oxetan-2-yl]methanol
Other name (6):
Oxetanocin
オキセタノシン
NK-84-0218
オキセタノシンA
Oxetanocin A
(2S)-4α-(6-Amino-9H-purin-9-yl)-2α,3β-oxetanedimethanol
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CAS registry number:
103913-16-2
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