10,11-Dihydroxy-1,2-dimethoxy-6,6-dimethyl-4,5,6aalpha,7-tetrahydro-6-aza-6H-benzo[de]anthracene-6-ium

Catalog Number	ACM142287965
CAS Number	142287-96-5
Molecular Weight	342.4
InChI	InChI=1S/C20H23NO4/c1-21(2)8-7-12-10-15(24-3)20(25-4)18-16(12)13(21)9-11-5-6-14(22)19(23)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1/t13-/m0/s1
InChI Key	BNLBUVFPTCUHTE-ZDUSSCGKSA-O
Purity	95%+
Complexity	498
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Exact Mass	342.17053325
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isomeric SMILES	C[N+]1(CCC2=CC(=C(C3=C2[C@@H]1CC4=C3C(=C(C=C4)O)O)OC)OC)C
Monoisotopic Mass	342.17053325
PhysicalState	Powder
Rotatable Bond Count	2
Topological Polar Surface Area	58.9 Ų

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