ursane

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 14
Total Number of Articles : 14
PubChem 9548870
Molecular Formula

C30H52

SMILES

C[C@@H]1CC[C@@]2(CC[C@@]3([C@@H]([C@@H]2[C@H]1C)CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CCCC5(C)C)C)C)C)C

InChI

InChI=1S/C30H52/c1-20-12-16-27(5)18-19-29(7)22(25(27)21(20)2)10-11-24-28(6)15-9-14-26(3,4)23(28)13-17-30(24,29)8/h20-25H,9-19H2,1-8H3/t20-,21+,22-,23+,24-,25+,27-,28+,29-,30-/m1/s1

synonyms
  • ursane
  • (1S,2R,4aR,6aR,6aR,6bR,8aS,12aS,14aR,14bS)-1,2,4a,6a,6b,9,9,12a-octamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a,14b-hexadecahydro-1H-picene
  • CHEBI:35711
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Properties
Property Value
MW 412.7 g/mol
HBD 0
HBA 0
Rotatable Bond Count 0
Exact Mass 412.406901659 g/mol
Monoisotopic Mass 412.406901659 g/mol
Heavy Atom Count 30
Isotope Atom Count 0
Atom Stereo Count 10
Covalent Unit Count 1
Complexity 690
xlogp 11.5
Topological Polar Surface Area 0