Chem
J-GLOBAL ID:200907003213749454
Nikkaji number:J2.082.732G
9-(2-O,3-O,5-O-Trimesityl-β-D-ribofuranosyl)-6-iodo-9H-purine
9-(2-O,3-O,5-O-トリメシチル-β-D-リボフラノシル)-6-ヨード-9H-プリン
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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:
C37 H41 IN4 O4
Molecular formula furigana:
C37-H41-I-N4-O4
Molecular weight:
732.663
InChI:
InChI=1S/C37H41IN4O4/c1-19-10-22(4)30(23(5)11-19)43-16-28-33(45-31-24(6)12-20(2)13-25(31)7)34(46-32-26(8)14-21(3)15-27(32)9)37(44-28)42-18-41-29-35(38)39-17-40-36(29)42/h10-15,17-18,28,33-34,37H,16H2,1-9H3/t28-,33-,34-,37-/m1/s1
InChI key:
YHVUWLKAJBTWEK-RJZNYRSSSA-N
SMILES:
Cc1cc(C)c(OC[C@H]2O[C@H]([C@H](Oc3c(C)cc(C)cc3C)[C@@H]2Oc2c(C)cc(C)cc2C)n2cnc3c(I)ncnc23)c(C)c1
Systematic name (3):
9-(2-O,3-O,5-O-トリメシチル-β-D-リボフラノシル)-6-ヨード-9H-プリン
9-[(2R,3R,4R,5R)-3,4-ビス(2,4,6-トリメチルフェノキシ)-5-[(2,4,6-トリメチルフェノキシ)メチル]オキソラン-2-イル]-6-ヨード-9H-プリン
9-[(2R,3R,4R,5R)-3,4-bis(2,4,6-trimethylphenoxy)-5-[(2,4,6-trimethylphenoxy)methyl]oxolan-2-yl]-6-iodo-9H-purine
Other name (1):
9-(2-O,3-O,5-O-Trimesityl-β-D-ribofuranosyl)-6-iodo-9H-purine
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