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Home > Encyclopedia > Methyl (αE,2S,3S,12bS)-3-ethyl-1,2,3,4,6,7,12,12b-octahydro-α-(methoxymethylene)indolo[2,3-a]quinolizine-2-acetate

Methyl (αE,2S,3S,12bS)-3-ethyl-1,2,3,4,6,7,12,12b-octahydro-α-(methoxymethylene)indolo[2,3-a]quinolizine-2-acetate

Methyl (αE,2S,3S,12bS)-3-ethyl-1,2,3,4,6,7,12,12b-octahydro-α-(methoxymethylene)indolo[2,3-a]quinolizine-2-acetate structure

Methyl (αE,2S,3S,12bS)-3-ethyl-1,2,3,4,6,7,12,12b-octahydro-α-(methoxymethylene)indolo[2,3-a]quinolizine-2-acetate 

structure
  • CAS No:

    23407-35-4

  • Formula:

    C22H28N2O3

  • Chemical Name:

    Methyl (αE,2S,3S,12bS)-3-ethyl-1,2,3,4,6,7,12,12b-octahydro-α-(methoxymethylene)indolo[2,3-a]quinolizine-2-acetate

  • Synonyms:

    Indolo[2,3-a]quinolizine-2-acetic acid,3-ethyl-1,2,3,4,6,7,12,12b-octahydro-α-(methoxymethylene)-,methyl ester,(αE,2S,3S,12bS)-;17,18-Seco-20α-yohimban-16-carboxylic acid,16,17-didehydro-17-methoxy-,methyl ester,(E)-;Corynantheidine;Corynan-16-carboxylic acid,16,17-didehydro-17-methoxy-,methyl ester,(16E,20β)-;Methyl (αE,2S,3S,12bS)-3-ethyl-1,2,3,4,6,7,12,12b-octahydro-α-(methoxymethylene)indolo[2,3-a]quinolizine-2-acetate;Epidihydrocorynantheine;Indolo[2,3-a]quinolizine-2-acetic acid,3-ethyl-1,2,3,4,6,7,12,12b-octahydro-α-(methoxymethylene)-,methyl ester,[2S-[2α(E),3α,12bβ]]-;(-)-Corynantheidine;522-95-2;7729-21-7;18910-73-1

Description

ChEBI: A natural product found in Uncaria macrophylla.


Corynantheidine is an alkaloid. It has a role as a metabolite.

Methyl (αE,2S,3S,12bS)-3-ethyl-1,2,3,4,6,7,12,12b-octahydro-α-(methoxymethylene)indolo[2,3-a]quinolizine-2-acetate Basic Attributes

368.46932

368.47

QMP2RF3L41

Characteristics

54.6

3.4

1.20±0.1 g/cm3(Predicted)

117 °C

Drug Information

18,19-dihydrocorynantheine

Computed Properties

Molecular Weight:368.5
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:368.20999276
Monoisotopic Mass:368.20999276
Topological Polar Surface Area:54.6
Heavy Atom Count:27
Complexity:578
Defined Atom Stereocenter Count:3
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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