Structure

Speciociliatine(sh)

CAS
14382-79-7
Catalog Number
ACM14382797
Category
Other Products
Molecular Weight
398.5
Molecular Formula
C23H30N2O4

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Specification

Synonyms
Speciociliatin, Speciociliatine, (3|A,16E,20|A)-16,17-Didehydro-9,17-dimethoxycorynan-16-carboxylic Acid Methyl Ester, (|AE,2S,3S,12bR)-3-ethyl-1,2,3,4,6,7,12,12b-octahydro-8-methoxy-|A-(methoxymethylene)indolo[2,3-a]quinolizine-2-acetic Acid Methyl Ester, (E)-16,17-Didehydro-9,17-dimethoxy-17,18-seco-3|A,20|A-yohimban-16-carboxylic Acid Methyl Ester, 14382-79-7
IUPAC Name
methyl (E)-2-[(2S,3S,12bR)-3-ethyl-8-methoxy-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate
SMILES
CCC1CN2CCC3=C(C2CC1C(=COC)C(=O)OC)NC4=C3C(=CC=C4)OC
InChI Key
LELBFTMXCIIKKX-MYLQJJOTSA-N
Exact Mass
398.22100
H-Bond Acceptor
5
H-Bond Donor
1

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