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(Q105217722)
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English
(S)-nantenine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
aporphine alkaloids
0 references
mass
363.147058152
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₂₁NO₄
0 references
canonical SMILES
O=C(C=1C=C2C3=C(C4=CC=5OCOC5C=C4CC3N(C)CC2)C1C(=O)C)C
0 references
isomeric SMILES
CC(=O)c1cc2c3c(c1C(C)=O)-c1cc4c(cc1C[C@@H]3N(C)CC2)OCO4
0 references
found in taxon
Nandina domestica
1 reference
stated in
Online structural elucidation of alkaloids and other constituents in crude extracts and cultured cells of Nandina domestica by combination of LC-MS/MS, LC-NMR, and LC-CD analyses
Identifiers
InChI
InChI=1S/C22H21NO4/c1-11(24)15-6-13-4-5-23(3)17-7-14-8-18-19(27-10-26-18)9-16(14)22(21(13)17)20(15)12(2)25/h6,8-9,17H,4-5,7,10H2,1-3H3/t17-/m0/s1
0 references
InChIKey
QBCMSGDOKGQABG-KRWDZBQOSA-N
0 references
PubChem CID
46225254
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QBCMSGDOKGQABG-KRWDZBQOSA-N
UniChem compound ID
88475
1 reference
stated in
UniChem
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