• 
  [Synonyms]
  
  [Structure]
  
  
  
  [ Properties Computed from Structure]
  

  Molecular Weight	540.73062 [g/mol]
  Molecular Formula	C33H48O6
  XLogP	5.1
  H-Bond Donor	2
  H-Bond Acceptor	6
  Rotatable Bond Count	15
  Tautomer Count	5
  Exact Mass	540.345089
  MonoIsotopic Mass	540.345089
  Topological Polar Surface Area	101
  Heavy Atom Count	39
  Formal Charge	0
  Complexity	1020
  Isotope Atom Count	0
  Defined Atom StereoCenter Count	7
  Undefined Atom StereoCenter Count	0
  Defined Bond StereoCenter Count	0
  Undefined Bond StereoCenter Count	5
  Covalently-Bonded Unit Count	1

  
  [ Descriptors Computed from Structure]
  IUPAC Name: (5S,6R,7S,9R,15R)-17-ethyl-6-hydroxy-3,5,7,9,11,15-hexamethyl-19-[(2R,
  3S)-3-methyl-6-oxo-2,3-dihydropyran-2-yl]-8-oxononadeca-2,10,12,16,
  18-pentaenoic acid
  Canonical SMILES: CCC(=CC(C)CC=CC(=CC(C)C(=O)C(C)C(C(C)CC(=CC(=O)O)C)O)C)C=CC1C(C=CC(=O)
  O1)C
  Isomeric SMILES: CCC(=C[C@H](C)CC=CC(=C[C@@H](C)C(=O)[C@@H](C)[C@@H]([C@@H](C)CC(=CC(=O)
  O)C)O)C)C=C[C@@H]1[C@H](C=CC(=O)O1)C
  InChI: InChI=1/C33H48O6/c1-9-28(14-15-29-24(5)13-16-31(36)39-29)19-22(3)12-10-
  11-21(2)17-25(6)32(37)27(8)33(38)26(7)18-23(4)20-30(34)35/h10-11,13-17,
  19-20,22,24-27,29,33,38H,9,12,18H2,1-8H3,(H,34,35)/t22-,24+,25-,26+,27-,
  29-,33-/m1/s1/f/h34H