Buprenorphine

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 194
Total Number of Articles : 293
PubChem 644073
Molecular Formula

C29H41NO4

SMILES

C[C@]([C@H]1C[C@@]23CC[C@@]1([C@H]4[C@@]25CCN([C@@H]3CC6=C5C(=C(C=C6)O)O4)CC7CC7)OC)(C(C)(C)C)O

InChI

InChI=1S/C29H41NO4/c1-25(2,3)26(4,32)20-15-27-10-11-29(20,33-5)24-28(27)12-13-30(16-17-6-7-17)21(27)14-18-8-9-19(31)23(34-24)22(18)28/h8-9,17,20-21,24,31-32H,6-7,10-16H2,1-5H3/t20-,21-,24-,26+,27-,28+,29-/m1/s1

synonyms
  • buprenorphine
  • Temgesic
  • 52485-79-7
Click to show/hide the synonyms
Properties
Property Value
MW 467.6 g/mol
HBD 2
HBA 5
Rotatable Bond Count 5
Exact Mass 467.30355879 g/mol
Monoisotopic Mass 467.30355879 g/mol
Heavy Atom Count 34
Isotope Atom Count 0
Atom Stereo Count 7
Covalent Unit Count 1
Complexity 869
xlogp 5
Topological Polar Surface Area 62.2