Actinodaphnine

Catalog Number	ACM517691
CAS Number	517-69-1
Synonyms	(7aS)-6,7,7a,8-Tetrahydro-11-methoxy-5H-benzo[g]-1,3-benzodioxolo[6,5,4-de]quinolin-10-ol
Molecular Weight	311.3
InChI	InChI=1S/C18H17NO4/c1-21-14-7-11-10(5-13(14)20)4-12-16-9(2-3-19-12)6-15-18(17(11)16)23-8-22-15/h5-7,12,19-20H,2-4,8H2,1H3/t12-/m0/s1
InChI Key	VYJUHRAQPIBWNV-LBPRGKRZSA-N
Melting Point	211 °C
Purity	95%+
Complexity	460
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Exact Mass	311.11575802
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isomeric SMILES	COC1=C(C=C2C[C@H]3C4=C(C2=C1)C5=C(C=C4CCN3)OCO5)O
Monoisotopic Mass	311.11575802
PhysicalState	Powder
Rotatable Bond Count	1
Topological Polar Surface Area	60 Ų

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