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Catalog Number | ACM78510197 |
CAS Number | 78510-19-7 |
Synonyms | N-Feruloyl-3-Methoxytyramine |
Molecular Weight | 343.4 |
InChI | InChI=1S/C19H21NO5/c1-24-17-11-13(3-6-15(17)21)5-8-19(23)20-10-9-14-4-7-16(22)18(12-14)25-2/h3-8,11-12,21-22H,9-10H2,1-2H3,(H,20,23)/b8-5+ |
InChI Key | GRXBVKANHNUZNL-VMPITWQZSA-N |
Purity | 95%+ |
Complexity | 442 |
Covalently-Bonded Unit Count | 1 |
Defined Atom Stereocenter Count | 0 |
Exact Mass | 343.14197277 |
Heavy Atom Count | 25 |
Hydrogen Bond Acceptor Count | 5 |
Hydrogen Bond Donor Count | 3 |
Isomeric SMILES | COC1=C(C=CC(=C1)CCNC(=O)/C=C/C2=CC(=C(C=C2)O)OC)O |
Monoisotopic Mass | 343.14197277 |
PhysicalState | Powder |
Rotatable Bond Count | 7 |
Topological Polar Surface Area | 88 Ų |
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