Celaphal A

CAS	244204-40-8
Structure
Synonyms	(4aR)-2,3,4,4a-Tetrahydro-6,7,10-trihydroxy-1,1,4a-trimethyl-9(1H)-phenanthrenone
IUPAC Name	(4aR)-6,7,10-trihydroxy-1,1,4a-trimethyl-3,4-dihydro-2H-phenanthren-9-one
Molecular Weight	288.34
Molecular Formula	C17H20O4
Canonical SMILES	C[C@]12CCCC(C1=C(C(=O)C3=CC(=C(C=C23)O)O)O)(C)C
InChI	InChI=1S/C17H20O4/c1-16(2)5-4-6-17(3)10-8-12(19)11(18)7-9(10)13(20)14(21)15(16)17/h7-8,18-19,21H,4-6H2,1-3H3/t17-/m1/s1
InChI Key	MLGLJFWISHCOAE-QGZVFWFLSA-N
Boiling Point	532.9±50.0 °C
Purity	98%
Density	1.34±0.1 g/ml
pKa	7.60±0.60
Appearance	Solid