(Q82682869)

English

2-Amino-9-[(6aR,8R,9S)-9-hydroxy-2,2,4,4-tetra(propan-2-yl)tetrahydro-2H,4H,6H-furo[3,2-f][1,3,5,2,4]trioxadisilocin-8-yl]-3,9-dihydro-6H-purin-6-one

group of stereoisomers with the chemical formula C₂₂H₃₉N₅O₆Si₂

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

525.243887028 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₂H₃₉N₅O₆Si₂

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based on heuristic

inferred from SMILES

canonical SMILES

CC(C)[Si]1(C(C)C)OCC2OC(n3cnc4c(O)nc(=N)[nH]c43)C(O)C2O[Si](C(C)C)(C(C)C)O1

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CC(C)[Si]1(C(C)C)OC[C@H]2O[C@@H](n3cnc4c(O)nc(=N)[nH]c43)[C@@H](O)C2O[Si](C(C)C)(C(C)C)O1

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C22H39N5O6Si2/c1-11(2)34(12(3)4)30-9-15-18(32-35(33-34,13(5)6)14(7)8)17(28)21(31-15)27-10-24-16-19(27)25-22(23)26-20(16)29/h10-15,17-18,21,28H,9H2,1-8H3,(H3,23,25,26,29)/t15-,17+,18?,21-/m1/s1

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InChIKey

CWVNMKRKFJYCCC-YQQPOAOISA-N

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1 reference

26 December 2021

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DSSTOX compound identifier

DTXCID40688624

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(Q82682869)

2-Amino-9-[(6aR,8R,9S)-9-hydroxy-2,2,4,4-tetra(propan-2-yl)tetrahydro-2H,4H,6H-furo[3,2-f][1,3,5,2,4]trioxadisilocin-8-yl]-3,9-dihydro-6H-purin-6-one

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