1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-7-methoxy-3,4-dihydroisoquinolin-6-ol;oxalic acid
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![1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-7-methoxy-3,4-dihydroisoquinolin-6-ol;oxalic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/8e4c8782ff394aa485a98029881a8aca.png "1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-7-methoxy-3,4-dihydroisoquinolin-6-ol;oxalic acid")
1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-7-methoxy-3,4-dihydroisoquinolin-6-ol;oxalic acid
structure -
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CAS No:
30959-09-2
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Formula:
C30H38N2O8
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Chemical Name:
1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-7-methoxy-3,4-dihydroisoquinolin-6-ol;oxalic acid
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Synonyms:
psychotrine dihydrogen oxalate;Psychotrine dihydrogen oxalate;30959-09-2;Emetan-6'-ol, 1',2'-didehydro-7',10,11-trimethoxy-, ethanedioate (1:2) (salt);DTXSID80953101;Oxalic acid--7',10,11-trimethoxy-1',5'-didehydro-5',6'-dihydroemetan-6'-one (1/1);1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-7-methoxy-3,4-dihydroisoquinolin-6-ol; oxalic acid
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CAS No:
1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-7-methoxy-3,4-dihydroisoquinolin-6-ol;oxalic acid Basic Attributes
554.6 g/mol
554.26281617 g/mol
Computed Properties
Molecular Weight:554.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:7
Exact Mass:554.26281617
Monoisotopic Mass:554.26281617
Topological Polar Surface Area:138
Heavy Atom Count:40
Complexity:788
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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