Chem
J-GLOBAL ID:200907097495157591
Nikkaji number:J962.621B
N-Cyclopentyl-2-chloro-2′-methyladenosine
N-シクロペンチル-2-クロロ-2′-メチルアデノシン
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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:
C16 H22 ClN5 O4
Molecular formula furigana:
C16-H22-CL-N5-O4
Molecular weight:
383.830
InChI:
InChI=1S/C16H22ClN5O4/c1-16(25)11(24)9(6-23)26-14(16)22-7-18-10-12(19-8-4-2-3-5-8)20-15(17)21-13(10)22/h7-9,11,14,23-25H,2-6H2,1H3,(H,19,20,21)/t9-,11-,14-,16-/m1/s1
InChI key:
MMPAUXMIDJWGFO-ROMFRFKVSA-N
SMILES:
C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(NC3CCCC3)nc(Cl)nc12
Systematic name (3):
N-シクロペンチル-2-クロロ-2′-メチルアデノシン
(2R,3R,4R,5R)-2-[2-クロロ-6-(シクロペンチルアミノ)-9H-プリン-9-イル]-5-(ヒドロキシメチル)-3-メチルオキソラン-3,4-ジオール
(2R,3R,4R,5R)-2-[2-chloro-6-(cyclopentylamino)-9H-purin-9-yl]-5-(hydroxymethyl)-3-methyloxolane-3,4-diol
Other name (1):
N-Cyclopentyl-2-chloro-2′-methyladenosine
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