14-Benzoylneoline

For Research Use Only.
Category
Alkaloids
Cat.No.
NP0259
CAS
99633-05-3
Product Name
14-Benzoylneoline
Structure

Product Details

Description
14-Benzoylneoline is isolated from the roots of Aconitum carmichaeli.
Synonyms
14-O-Benzoylneoline; Neoline 14-benzoate
IUPAC Name
[11-ethyl-8,16-dihydroxy-6,18-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate
Molecular Weight
541.7
Molecular Formula
C31H43NO7
Canonical SMILES
CCN1CC2(CCC(C34C2C(C(C31)C5(CC(C6CC4C5C6OC(=O)C7=CC=CC=C7)OC)O)OC)O)COC
InChI
InChI=1S/C31H43NO7/c1-5-32-15-29(16-36-2)12-11-21(33)31-19-13-18-20(37-3)14-30(35,23(27(31)32)25(38-4)26(29)31)22(19)24(18)39-28(34)17-9-7-6-8-10-17/h6-10,18-27,33,35H,5,11-16H2,1-4H3
InChIKey
GDNPLILPTBDDEP-UHFFFAOYSA-N
Purity
> 95%
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