| SpectraBase Compound ID | Jjbnpw9VwMr |
|---|---|
| InChI | InChI=1S/C18H19NO4/c1-23-18-7-10-2-3-19-9-12-6-16(21)15(20)5-11(12)4-14(19)13(10)8-17(18)22/h5-8,14,20-22H,2-4,9H2,1H3/t14-/m0/s1 |
| InChIKey | NZFYGBOUVBINBH-AWEZNQCLSA-N |
| Mol Weight | 313.35 g/mol |
| Molecular Formula | C18H19NO4 |
| Exact Mass | 313.131408 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B3OLUsXZrXl |
|---|---|
| Name | Pessoine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H19NO4 |
| InChI | InChI=1S/C18H19NO4/c1-23-18-7-10-2-3-19-9-12-6-16(21)15(20)5-11(12)4-14(19)13(10)8-17(18)22/h5-8,14,20-22H,2-4,9H2,1H3/t14-/m0/s1 |
| InChIKey | NZFYGBOUVBINBH-AWEZNQCLSA-N |
| Molecular Weight | 313.353 g/mol |
| SMILES | Oc1c(cc2CCN3[C@@](Cc4c(cc(c(c4)O)O)C3)(c2c1)[H])OC |
| SPLASH | splash10-003r-6903000000-e6e397e06380de10371c |
| Source of Spectrum | G4-59-440-1 |
| Synonyms | (13aS)-3-methoxy-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinoline-2,10,11-triol (13aS)-3-methoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-2,10,11-triol (13aS)-3-methoxy-6,8,13,13a-tetrahydro-5H-isoquinolin[2,1-b]isoquinoline-2,10,11-triol |
| Wiley ID | 1606265 |