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
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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
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CAS No:
23407-35-4
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Formula:
C22H28N2O3
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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
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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
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CAS No:
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
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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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
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