Friedelin

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Catalog Number ACM559740
CAS 559-74-0
IUPAC Name (4R,4aS,6aS,6aS,6bR,8aR,12aR,14aS,14bS)-4,4a,6a,6b,8a,11,11,14a-octamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one
Synonyms 3-oxofriedelane; D:A-friedooleanan-3-one; Friedeline; 3-Friedelanone; FRIEDELAN-3-ONE; FRIEDELIN; Einecs 209-205-1; friedelane-3-one;
Molecular Weight 426.7
Molecular Formula C30H50O
Canonical SMILES CC1C(=O)CCC2C1(CCC3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C)C)C)C)C)C
Inchi InChI=1S/C30H50O/c1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20,22-24H,9-19H2,1-8H3/t20-,22+,23-,24+,26+,27+,28-,29+,30-/m0/s1
InChIKey OFMXGFHWLZPCFL-SVRPQWSVSA-N
Boiling Point 477.2ºC at 760mmHg
Melting Point 262-265ºC(lit.)
Flash Point 233.9ºC
Purity 98%
Density 0.963g/cm³
Appearance White powder

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