Ganodermanondiol

Category	HIV Protease
CAS	107900-76-5
Description	Ganodermanondiol is a triterpenoid compound found in the fruit body of Ganoderma lucidum. Study shows that Ganodermanondiol exhibits the inhibitory effect on the proliferation of HL60 and K562 human tumor cells.

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Synonyms	(5R,10S,13R,14R,17R)-17-[(2R,5S)-5,6-dihydroxy-6-methylheptan-2-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-3-one
IUPAC Name	(5R,10S,13R,14R,17R)-17-[(2R,5S)-5,6-dihydroxy-6-methylheptan-2-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-3-one
Molecular Weight	456.711
Molecular Formula	C30H48O3
Canonical SMILES	CC(CCC(C(C)(C)O)O)C1CCC2(C1(CC=C3C2=CCC4C3(CCC(=O)C4(C)C)C)C)C
InChI	InChI=1S/C30H48O3/c1-19(9-12-25(32)27(4,5)33)20-13-17-30(8)22-10-11-23-26(2,3)24(31)15-16-28(23,6)21(22)14-18-29(20,30)7/h10,14,19-20,23,25,32-33H,9,11-13,15-18H2,1-8H3/t19-,20-,23+,25+,28-,29-,30+/m1/s1
InChIKey	AAJIHHYEPHRIET-XEFAKFPISA-N
Boiling Point	580.4±50.0 °C at 760 mmHg
Flash Point	318.9±26.6 °C
Purity	>98%
Density	1.1±0.1 g/cm3
Solubility	Soluble in DMSO
Appearance	Solid powder
Storage	Store at -20°C
Complexity	879
Exact Mass	456.36034539
Index Of Refraction	1.547
PSA	57.53000
Target	HIV Protease
Vapor Pressure	0.0±3.7 mmHg at 25°C
XLogP3-AA	5.8