Chemical Properties of 5'-S-Methyl-5'-thioadenosine, O,O'-bis(trifluoroacetyl)-

5'-S-Methyl-5'-thioadenosine, O,O'-bis(trifluoroacetyl)-

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InChI
InChI=1S/C15H13F6N5O5S/c1-32-2-5-7(30-12(27)14(16,17)18)8(31-13(28)15(19,20)21)11(29-5)26-4-25-6-9(22)23-3-24-10(6)26/h3-5,7-8,11H,2H2,1H3,(H2,22,23,24)
InChI Key
XIKNMXIIAMFOHZ-UHFFFAOYSA-N
Formula
C15H13F6N5O5S
SMILES
CSCC1OC(n2cnc3c(N)ncnc32)C(OC(=O)C(F)(F)F)C1OC(=O)C(F)(F)F
Molecular Weight1
489.35
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Physical Properties

Property Value Unit Source
log10WS -4.53 Crippen Calculated Property
logPoct/wat 1.617 Crippen Calculated Property
McVol 270.050 ml/mol McGowan Calculated Property
Inp 2341.80 NIST

Similar Compounds

Nalmefene. 3-O,6-O,N-Triacetylnormorphine. Benzylmorphine. Nicocodine. Buprenorphine. Dihydroergokryptine. Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Deserpidine. Paclitaxel. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Ergotamine. Ergocristine.

Find more compounds similar to 5'-S-Methyl-5'-thioadenosine, O,O'-bis(trifluoroacetyl)-.

Sources

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