Trecadrine | |
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Molecular structure via molpic | |
Conformer structure via 3Dmol.js | |
Molecular formula | C27H29NO[1] |
Molecular mass | 383.5 g/mol[1] |
Predicted LogP | 5.2[1] |
Chirality | absolute[2] |
Identifiers [] | |
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IUPAC name | (1R,2S)-2-[methyl-[2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylidene)ethyl]amino]-1-phenylpropan-1-ol[1] |
SMILES | C[C@@H]([C@@H](C1=CC=CC=C1)O)N(C)CC=C2C3=CC=CC=C3CCC4=CC=CC=C42[1] |
InChI | InChI=1S/C27H29NO/c1-20(27(29)23-12-4-3-5-13-23)28(2)19-18-26-24-14-8-6-10-21(24)16-17-22-11-7-9-15-25(22)26/h3-15,18,20,27,29H,16-17,19H2,1-2H3/t20-,27-/m0/s1[1] |
InChIKey | BHVGOYREXHCFOE-DCFHFQCYSA-N[1] |
Dosing |
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Trecadrine
Trecadrine (also known as Trecadrina, Trecadrinum, (1-((2-(10,11-dihydro-5H-dibenzo(a,d)cyclohepten-5-ylidene)ethyl)methylamino)ethy)benzyl alcohol or (1R,2S)-α-(1-((2-(10,11-Dihydro-5H-dibenzo(a,d)cyclohepten-5-ylidene)ethyl)methylamino)ethyl)benzyl alcohol) is a substance of the phenylethanolamine class.
Chemistry
Stereochemistry
Trecadrine is a absolute mixture