Alletorphine
[CAS# 23758-80-7]

Identification

• Name: Alletorphine
• Synonyms: 17-Allyl-17-Demethyl-7Alpha-((R)-1-Hydroxy-1-Methylbutyl)-6,14-Endo-Ethenotetrahydrooripavine; 6,14-Ethenomorphinan-7-Methanol, 4,5-Epoxy-3-Hydroxy-6-Methoxy-Alpha-Methyl-17-(2-Propenyl)-Alpha-Propyl-, (5Alpha,7Alpha(R))-; 6,14-Ethenomorphinan-7-Methanol, 4,5-Epoxy-3-Hydroxy-6-Methoxy-Alpha-Methyl-17-(2-Propenyl)-Alpha-Propyl-, (Alphar,5Alpha,7Alpha)-
• Molecular Formula: C₂₇H₃₅NO₄
• Molecular Weight: 437.58
• CAS Registry Number: 23758-80-7
• SMILES: [C@@](O)(C5C6(OC)C2OC1=C(O)C=CC4=C1C23C(C(N(CC3)CC=C)C4)(C5)C=C6)(CCC)C
• InChI: 1S/C27H35NO4/c1-5-9-24(3,30)19-16-25-10-11-27(19,31-4)23-26(25)12-14-28(13-6-2)20(25)15-17-7-8-18(29)22(32-23)21(17)26/h6-8,10-11,19-20,23,29-30H,2,5,9,12-16H2,1,3-4H3/t19?,20?,23?,24-,25?,26?,27?/m1/s1
• InChIKey: OSQIRUUENNTOQL-MWFGDBNCSA-N

Properties

• Density: 1.278g/cm³ (Cal.)
• Boiling point: 568.799°C at 760 mmHg (Cal.)
• Flash point: 297.799°C (Cal.)