Cuscuta propenamide 1

Catalog Number	ACM189307479-1
CAS Number	189307-47-9
Synonyms	N-Caffeoyl-O-methyltyramine
Molecular Weight	313.3
InChI	InChI=1S/C18H19NO4/c1-23-15-6-2-13(3-7-15)10-11-19-18(22)9-5-14-4-8-16(20)17(21)12-14/h2-9,12,20-21H,10-11H2,1H3,(H,19,22)/b9-5+
InChI Key	JRKPLTBLTYEYJJ-WEVVVXLNSA-N
Purity	90%+
Complexity	391
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Exact Mass	313.13140809
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isomeric SMILES	COC1=CC=C(C=C1)CCNC(=O)/C=C/C2=CC(=C(C=C2)O)O
Monoisotopic Mass	313.13140809
PhysicalState	Powder
Rotatable Bond Count	6
Topological Polar Surface Area	78.8 Ų

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