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Gelsenicine

Gelsenicine structure

Gelsenicine 

structure
  • CAS No:

    82354-38-9

  • Formula:

    C19H22N2O3

  • Chemical Name:

    Gelsenicine

  • Synonyms:

    Spiro[3H-indole-3,7′(6′H)-[3,6]methano[3H]oxepino[4,3-b]pyrrol]-2(1H)-one,2′-ethyl-3′a,4′,8′,8′a-tetrahydro-1-methoxy-,(3S,3′R,3′aS,6′R,8′aS)-;Gelsedine,4,20-didehydro-;(3S,3′R,3′aS,6′R,8′aS)-2′-Ethyl-3′a,4′,8′,8′a-tetrahydro-1-methoxyspiro[3H-indole-3,7′(6′H)-[3,6]methano[3H]oxepino[4,3-b]pyrrol]-2(1H)-one;Humantenmine;Spiro[3H-indole-3,7′(6′H)-[3,6]methano[3H]oxepino[4,3-b]pyrrol]-2(1H)-one,2′-ethyl-3′a,4′,8′,8′a-tetrahydro-9′-hydroxy-1-methoxy-,[3′R-(3′α,3′aβ,6′α,7′α,8′aβ)]-;4,20-Dehydrogelsedine;Gelsenicine;Kumantenmine;(-)-Gelsenicine

  • Categories:

    Natural Products  >  Alkaloids

Gelsenicine Basic Attributes

326.4

326.39

Characteristics

51.13000

3.68

1.4±0.1 g/cm3

463.6±55.0 °C at 760 mmHg

234.2±31.5 °C

1.712

Drug Information

humantenmine

Computed Properties

Molecular Weight:326.4
XLogP3:1.3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:326.16304257
Monoisotopic Mass:326.16304257
Topological Polar Surface Area:51.1
Heavy Atom Count:24
Complexity:591
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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