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Catalog Number | ACM25344541 |
CAS Number | 25344-54-1 |
Synonyms | (6R)-6-[(1S)-1,2,3,4-Tetrahydro-6-hydroxy-7-methoxy-2-methyl-1-isoquinolinyl]furo[3,4-e]-1,3-benzodioxol-8(6H)-one |
Molecular Weight | 369.4 |
Molecular Formula | C2OH19NO6 |
InChI | InChI=1S/C20H19NO6/c1-21-6-5-10-7-15(24-2)13(22)8-12(10)17(21)18-11-3-4-14-19(26-9-25-14)16(11)20(23)27-18/h3-4,7-8,17-18,22H,5-6,9H2,1-2H3/t17-,18+/m0/s1 |
InChI Key | IORPHWDBRHOADK-ZWKOTPCHSA-N |
Purity | 95%+ |
Density | 1.417 |
Complexity | 587 |
Covalently-Bonded Unit Count | 1 |
Defined Atom Stereocenter Count | 2 |
Exact Mass | 369.12123733 |
Heavy Atom Count | 27 |
Hydrogen Bond Acceptor Count | 7 |
Hydrogen Bond Donor Count | 1 |
Isomeric SMILES | CN1CCC2=CC(=C(C=C2[C@H]1[C@H]3C4=C(C5=C(C=C4)OCO5)C(=O)O3)O)OC |
Monoisotopic Mass | 369.12123733 |
PhysicalState | Powder |
Rotatable Bond Count | 2 |
Topological Polar Surface Area | 77.5 Ų |
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