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English
1-Acetylaspidospermidine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Aspidospermidine, 1-acetyl-
1 reference
based on heuristic
inferred from SMILES
mass
324.220163516
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
1-[(1R,9R,12S,19S)-12-ethyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6-trien-8-yl]ethanone
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₂₁H₂₈N₂O
0 references
canonical SMILES
O=C(N1C=2C=CC=CC2C34CCN5CCCC(CC)(CCC13)C54)C
0 references
isomeric SMILES
CC[C@@]12CCCN3CC[C@]4(c5ccccc5N(C(C)=O)[C@@H]4CC1)[C@H]32
0 references
found in taxon
Rhazya stricta
1 reference
stated in
Alkaloids from Rhazya stricta
Geissospermum argenteum
1 reference
stated in
Alcaloides de Geissospermum argenteum (apocynaceae)
Identifiers
InChI
InChI=1S/C21H28N2O/c1-3-20-10-6-13-22-14-12-21(19(20)22)16-7-4-5-8-17(16)23(15(2)24)18(21)9-11-20/h4-5,7-8,18-19H,3,6,9-14H2,1-2H3/t18-,19-,20-,21-/m1/s1
0 references
InChIKey
GAVJVWWZBPAPEL-XRXFAXGQSA-N
0 references
PubChem CID
13943056
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
GAVJVWWZBPAPEL-XRXFAXGQSA-N
UniChem compound ID
53141192
1 reference
stated in
UniChem
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