14-O-Acetylneoline

For Research Use Only.
Category
Alkaloids
Cat.No.
NP0874
CAS
1354-86-5
Product Name
14-O-Acetylneoline
Structure

Product Details

Description
14-O-acetylneoline is a natural product found in Aconitum carmichaelii.
Synonyms
14-Acetylneoline
IUPAC Name
[(1S,2R,3R,4S,5R,6S,8R,9S,13S,16S,17R,18R)-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] acetate
Molecular Weight
479.61
Molecular Formula
C26H41NO7
Canonical SMILES
CCN1CC2(CCC(C34C2C(C(C31)C5(CC(C6CC4C5C6OC(=O)C)OC)O)OC)O)COC
InChI
InChI=1S/C26H41NO7/c1-6-27-11-24(12-31-3)8-7-17(29)26-15-9-14-16(32-4)10-25(30,18(15)20(14)34-13(2)28)19(23(26)27)21(33-5)22(24)26/h14-23,29-30H,6-12H2,1-5H3/t14-,15-,16+,17+,18-,19-,20+,21+,22-,23?,24+,25-,26+/m1/s1
InChIKey
RVSYWRBZSPBTQV-YMKZMQERSA-N
Purity
98%
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