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Fetidine

Fetidine structure

CAS No:
7072-86-8
Formula:
C40H46N2O8
Chemical Name:
Fetidine
Synonyms:
4H-Dibenzo[de,g]quinolin-1-ol,9-[2,3-dimethoxy-6-[[(1S)-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl]methyl]phenoxy]-5,6,6a,7-tetrahydro-2,10-dimethoxy-6-methyl-,(6aS)-;4H-Dibenzo[de,g]quinolin-1-ol,9-[2,3-dimethoxy-6-[(1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)methyl]phenoxy]-5,6,6a,7-tetrahydro-2,10-dimethoxy-6-methyl-,[S-(R*,R*)]-;6aα-Aporphin-1-ol,9-[[5,6-dimethoxy-α-((R)-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolyl)-m-tolyl]oxy]-2,10-dimethoxy-;(6aS)-9-[2,3-Dimethoxy-6-[[(1S)-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl]methyl]phenoxy]-5,6,6a,7-tetrahydro-2,10-dimethoxy-6-methyl-4H-dibenzo[de,g]quinolin-1-ol;Fetidine
Categories:
Chemical Reagents > Organic Reagents

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Description

Fetidine is a bisbenzylisoquinoline alkaloid.

Fetidine Basic Attributes

Molecular Weight：

682.8 g/mol

Exact Mass：

682.80

DSSTox ID：

DTXSID10331776

Characteristics

PSA：

91.3 Å²

Melting Point：

132-135 °C

Computed Properties

Molecular Weight:682.8
XLogP3:6.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:10
Exact Mass:682.32541643
Monoisotopic Mass:682.32541643
Topological Polar Surface Area:91.3
Heavy Atom Count:50
Complexity:1100
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes