Chem
J-GLOBAL ID:200907017380846993
Nikkaji number:J1.229.678I
2-Amino-9-[3α-(3-hydroxypropyl)-2,2-dimethylcyclobutane-1α-yl]-1H-purine-6(9H)-one
2-アミノ-9-[3α-(3-ヒドロキシプロピル)-2,2-ジメチルシクロブタン-1α-イル]-1H-プリン-6(9H)-オン
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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:
C14 H21 N5 O2
Molecular formula furigana:
C14-H21-N5-O2
Molecular weight:
291.355
InChI:
InChI=1S/C14H21N5O2/c1-14(2)8(4-3-5-20)6-9(14)19-7-16-10-11(19)17-13(15)18-12(10)21/h7-9,20H,3-6H2,1-2H3,(H3,15,17,18,21)/t8-,9+/m1/s1
InChI key:
MKVSIROTWRRYNB-BDAKNGLRSA-N
SMILES:
CC1(C)[C@H](CCCO)C[C@@H]1n1cnc2c1nc(N)[nH]c2=O
Systematic name (3):
2-アミノ-9-[3α-(3-ヒドロキシプロピル)-2,2-ジメチルシクロブタン-1α-イル]-1H-プリン-6(9H)-オン
2-アミノ-9-[(1S,3R)-3-(3-ヒドロキシプロピル)-2,2-ジメチルシクロブチル]-6,9-ジヒドロ-1H-プリン-6-オン
2-amino-9-[(1S,3R)-3-(3-hydroxypropyl)-2,2-dimethylcyclobutyl]-6,9-dihydro-1H-purin-6-one
Other name (1):
2-Amino-9-[3α-(3-hydroxypropyl)-2,2-dimethylcyclobutane-1α-yl]-1H-purine-6(9H)-one
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