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1629853-48-0

1629853-48-0 Structure

1629853-48-0 Structure
IdentificationBack Directory
[Name]

26,27-Dinorergost-5-ene-3,24-diol, 25,25,25-trifluoro-3-methyl-, (3β,24S)-
[CAS]

1629853-48-0
[Synonyms]

SAGE-718
Dalzanemdor
26,27-Dinorergost-5-ene-3,24-diol, 25,25,25-trifluoro-3-methyl-, (3β,24S)-
[Molecular Formula]

C27H43F3O2
[MOL File]

1629853-48-0.mol
[Molecular Weight]

456.63
Chemical PropertiesBack Directory
[Boiling point ]

515.3±45.0 °C(Predicted)
[density ]

1.13±0.1 g/cm3(Predicted)
[pka]

12.52±0.29(Predicted)
[InChIKey]

BVBRUQYHUXKZMQ-BCHCEAAZNA-N
[SMILES]

C[C@]12CC[C@@](O)(C)CC1=CC[C@@]1([H])[C@]3([H])CC[C@]([H])([C@H](C)CC[C@@](O)(C)C(F)(F)F)[C@@]3(C)CC[C@]21[H] |&1:1,4,11,13,17,19,23,30,34,r|
Spectrum DetailBack Directory
[Spectrum Detail]

26,27-Dinorergost-5-ene-3,24-diol, 25,25,25-trifluoro-3-methyl-, (3β,24S)-(1629853-48-0)1HNMR
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