3-[6-(2,2-Diphenylethylamino)-2-(2-piperidin-1-ylethylamino)purin-9-yl]-5-[4-(hydroxymethyl)pyrazol-1-yl]cyclopentane-1,2-diol

基本情報

標準SMILES: OCc1cnn(C2CC(n3cnc4c(NCC(c5ccccc5)c5ccccc5)nc(NCCN5CCCCC5)nc43)C(O)C2O)c1
InChIKey: SFWUTURFNPXUNY-UHFFFAOYSA-N
分子式: C35H43N9O3
平均分子量: 637.8 g/mol
単同位体質量: 637.34888627

優先名称: 3-[6-(2,2-Diphenylethylamino)-2-(2-piperidin-1-ylethylamino)purin-9-yl]-5-[4-(hydroxymethyl)pyrazol-1-yl]cyclopentane-1,2-diol
IUPAC: 3-[6-(2,2-diphenylethylamino)-2-(2-piperidin-1-ylethylamino)purin-9-yl]-5-[4-(hydroxymethyl)pyrazol-1-yl]cyclopentane-1,2-diol

7 件

HRID 144789反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

HRID 934652反応物としてValidation data from https://doi.org/10.1039/C8SC04228D

HRID 940024反応物としてValidation data from https://doi.org/10.1039/C8SC04228D

HRID 952337反応物としてValidation data from https://doi.org/10.1039/C8SC04228D

HRID 1127227反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

HRID 1559998反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

HRID 2122227反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

読み込み中…

標準SMILES: OCc1cnn(C2CC(n3cnc4c(NCC(c5ccccc5)c5ccccc5)nc(NCCN5CCCCC5)nc43)C(O)C2O)c1
InChIKey: SFWUTURFNPXUNY-UHFFFAOYSA-N
分子式: C35H43N9O3
平均分子量: 637.8 g/mol
単同位体質量: 637.34888627

優先名称: 3-[6-(2,2-Diphenylethylamino)-2-(2-piperidin-1-ylethylamino)purin-9-yl]-5-[4-(hydroxymethyl)pyrazol-1-yl]cyclopentane-1,2-diol
IUPAC: 3-[6-(2,2-diphenylethylamino)-2-(2-piperidin-1-ylethylamino)purin-9-yl]-5-[4-(hydroxymethyl)pyrazol-1-yl]cyclopentane-1,2-diol

7 件