Gomisin M2

CAS	82425-45-4
Synonyms	Benzo[3,4]cycloocta[1,2-f][1,3]benzodioxol-13-ol, 5,6,7,8-tetrahydro-1,2,3-trimethoxy-6,7-dimethyl-, (6S,7R,13aR)-
IUPAC Name	(9S,10R)-3,4,5-trimethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-19-ol
Molecular Weight	386.4
Molecular Formula	C22H26O6
Canonical SMILES	CC1CC2=CC3=C(C(=C2C4=C(C(=C(C=C4CC1C)OC)OC)OC)O)OCO3
InChI	InChI=1S/C22H26O6/c1-11-6-13-9-16-20(28-10-27-16)19(23)17(13)18-14(7-12(11)2)8-15(24-3)21(25-4)22(18)26-5/h8-9,11-12,23H,6-7,10H2,1-5H3/t11-,12+/m1/s1
InChI Key	PDDXWOMYBJCSQB-NEPJUHHUSA-N
Boiling Point	558.5±50.0 °C
Purity	98%
Density	1.195±0.06 g/ml
pKa	8.96±0.60
Appearance	Powder