(Q72468677)

English

5'-O-(4,4-Dimethoxytrityl)-2'-deoxy-2'-fluorouridine-3'-(2-cyanoethyl-N,N-diisopropyl)phosphoramidite

group of stereoisomers with the chemical formula C₃₉H₄₆FN₄O₈P

5'-O-DMT-2'-F-dU-3'-CEDPA

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

748.3037292820001 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₉H₄₆FN₄O₈P

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canonical SMILES

COc1ccc(C(OCC2OC(n3ccc(O)nc3=O)C(F)C2OP(OCCC#N)N(C(C)C)C(C)C)(c2ccccc2)c2ccc(OC)cc2)cc1

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

COc1ccc(C(OC[C@H]2O[C@@H](n3ccc(O)nc3=O)[C@H](F)[C@@H]2OP(OCCC#N)N(C(C)C)C(C)C)(c2ccccc2)c2ccc(OC)cc2)cc1

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C39H46FN4O8P/c1-26(2)44(27(3)4)53(50-24-10-22-41)52-36-33(51-37(35(36)40)43-23-21-34(45)42-38(43)46)25-49-39(28-11-8-7-9-12-28,29-13-17-31(47-5)18-14-29)30-15-19-32(48-6)20-16-30/h7-9,11-21,23,26-27,33,35-37H,10,24-25H2,1-6H3,(H,42,45,46)/t33-,35-,36-,37-,53?/m1/s1

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InChIKey

HQHQPAYRJJMYQX-DJTPZYMWSA-N

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26 December 2021

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DSSTOX compound identifier

DTXCID60381822

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Probes And Drugs ID

PD157954

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(Q72468677)

5'-O-(4,4-Dimethoxytrityl)-2'-deoxy-2'-fluorouridine-3'-(2-cyanoethyl-N,N-diisopropyl)phosphoramidite

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