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(8S,13aS)-2,10-dimethoxy-8-methylol-6,8,13,13a-tetrahydro-5H-isoquinolin[2,1-b]isoquinoline-1,11-diol
SpectraBase Compound ID FIxU0iQCmay
InChI InChI=1S/C20H23NO5/c1-25-17-4-3-11-5-6-21-14(19(11)20(17)24)7-12-8-16(23)18(26-2)9-13(12)15(21)10-22/h3-4,8-9,14-15,22-24H,5-7,10H2,1-2H3/t14-,15+/m0/s1
InChIKey BQLWITSRLZPGRR-LSDHHAIUSA-N
Mol Weight 357.41 g/mol
Molecular Formula C20H23NO5
Exact Mass 357.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5uH9vvj5s8F
Name (8S,13aS)-2,10-dimethoxy-8-methylol-6,8,13,13a-tetrahydro-5H-isoquinolin[2,1-b]isoquinoline-1,11-diol
CAS Registry Number 132074-88-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23NO5
InChI InChI=1S/C20H23NO5/c1-25-17-4-3-11-5-6-21-14(19(11)20(17)24)7-12-8-16(23)18(26-2)9-13(12)15(21)10-22/h3-4,8-9,14-15,22-24H,5-7,10H2,1-2H3/t14-,15+/m0/s1
InChIKey BQLWITSRLZPGRR-LSDHHAIUSA-N
Molecular Weight 357.406 g/mol
SMILES Oc1c(ccc2CCN3[C@@](Cc4c([C@]3(CO)[H])cc(c(c4)O)OC)(c12)[H])OC
SPLASH splash10-004i-0009000000-ae0cf9ba61c20d932ff0
Source of Spectrum F-46-4425-3
Synonyms (8S,13aS)-8-(hydroxymethyl)-2,10-dimethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-1,11-diol
Wiley ID 1346490