Anonamine

Catalog Number	ACM111566666
CAS Number	111566-66-6
Molecular Weight	382.4
InChI	InChI=1S/C19H28NO7/c1-12-10-13(6-9-21)16(22)27-15-5-8-20(3)7-4-14(19(15,20)25)11-26-17(23)18(12,2)24/h4,6,12,15,21,24-25H,5,7-11H2,1-3H3/q+1/b13-6+/t12-,15-,18-,19+,20/m1/s1
InChI Key	SFTHPGHXDNRVHD-FLRXXRQUSA-N
Purity	95%+
Complexity	717
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	4
Exact Mass	382.18657723
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	3
Isomeric SMILES	C[C@@H]1C/C(=C\CO)/C(=O)O[C@@H]2CC[N+]3([C@@]2(C(=CC3)COC(=O)[C@]1(C)O)O)C
Monoisotopic Mass	382.18657723
PhysicalState	Powder
Rotatable Bond Count	1
Topological Polar Surface Area	113 Ų

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