Tripdiolide

CAS	38647-10-8
Structure
Synonyms	2β-Hydroxytriptolide
IUPAC Name	(1S,2S,4S,5S,7R,8R,9S,11S,13S,19S)-8,19-dihydroxy-1-methyl-7-propan-2-yl-3,6,10,16-tetraoxaheptacyclo[11.7.0.02,4.02,9.05,7.09,11.014,18]icos-14(18)-en-17-one
Molecular Weight	376.4
Molecular Formula	C20H24O7
Canonical SMILES	CC(C)[C@@]12[C@@H](O1)[C@H]3[C@@]4(O3)[C@]5(C[C@@H](C6=C([C@@H]5C[C@H]7[C@]4([C@@H]2O)O7)COC6=O)O)C
InChI	InChI=1S/C20H24O7/c1-7(2)18-13(26-18)14-20(27-14)17(3)5-10(21)12-8(6-24-15(12)22)9(17)4-11-19(20,25-11)16(18)23/h7,9-11,13-14,16,21,23H,4-6H2,1-3H3/t9-,10-,11-,13-,14-,16+,17-,18-,19+,20+/m0/s1
InChI Key	PUJWFVBVNFXCHZ-SQEQANQOSA-N
Boiling Point	656.4±55.0 °C
Melting Point	226-228 °C
Purity	98%
Density	1.56±0.1 g/ml
pKa	13.50±0.70
Appearance	White powder