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Catalog Number | ACM88200015 |
CAS Number | 88200-01-5 |
Molecular Weight | 353.4 |
InChI | InChI=1S/C20H19NO5/c1-21-7-13-11(2-3-15-20(13)26-9-23-15)18-14(22)4-10-5-16-17(25-8-24-16)6-12(10)19(18)21/h2-3,5-6,14,18-19,22H,4,7-9H2,1H3/t14-,18-,19+/m1/s1 |
InChI Key | GHKISGDRQRSCII-ZMYBRWDISA-N |
Melting Point | 136 °C |
Purity | 95%+ |
Complexity | 560 |
Covalently-Bonded Unit Count | 1 |
Defined Atom Stereocenter Count | 3 |
Exact Mass | 353.12632271 |
Heavy Atom Count | 26 |
Hydrogen Bond Acceptor Count | 6 |
Hydrogen Bond Donor Count | 1 |
Isomeric SMILES | CN1CC2=C(C=CC3=C2OCO3)[C@H]4[C@@H]1C5=CC6=C(C=C5C[C@H]4O)OCO6 |
Monoisotopic Mass | 353.12632271 |
PhysicalState | Powder |
Rotatable Bond Count | 0 |
Topological Polar Surface Area | 60.4 Ų |
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