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(Q104252574)
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Verbacine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
8-Phenyl-1-(3-phenylprop-2-enoyl)-1,5,9,13-tetrazacycloheptadecan-6-one
1 reference
based on heuristic
inferred from SMILES
mass
462.299476456
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(8S)-8-phenyl-1-[(Z)-3-phenylprop-2-enoyl]-1,5,9,13-tetrazacycloheptadecan-6-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₂₈H₃₈N₄O₂
0 references
canonical SMILES
O=C1CC(c2ccccc2)NCCCNCCCCN(C(=O)C=Cc2ccccc2)CCCN1
0 references
isomeric SMILES
O=C1C[C@@H](c2ccccc2)NCCCNCCCCN(C(=O)/C=C/c2ccccc2)CCCN1
0 references
found in taxon
Verbascum pseudonobile
4 references
stated in
Separation of E-Z isomeric macrocyclic spermine alkakoids of Verbascum pseudonobile and Verbascum phoeniceum and of their derivatives using thin-layer chromatography
stated in
Macrocyclic Spermine Alkaloids fromVerbascum: The (E/Z)-Isomeric Pairs (−)-(S)-Verbasitrine/(−)-(S)-Isoverbasitrine and (+)-(S)-Verbametrine/(+)-(S)-Isoverbametrine: Isolation, Structure Elucidation, and Synthesis
stated in
Verbacine and verballocine, novel macrocyclic spermine alkaloids from Verbascum pseudonobile Stoj. et Stef. (Scrophulariaceae)
stated in
Verbacine and verballocine, novel macrocyclic spermine alkaloids from Verbascum pseudonobile Stoj. et Stef. (Scrophulariaceae)
Purple mullein
2 references
stated in
Separation of E-Z isomeric macrocyclic spermine alkakoids of Verbascum pseudonobile and Verbascum phoeniceum and of their derivatives using thin-layer chromatography
stated in
Verballoscenine, the Z isomer of verbascenine from Verbascum phoeniceum
Identifiers
InChI
InChI=1S/C28H38N4O2/c33-27-23-26(25-13-5-2-6-14-25)30-19-9-18-29-17-7-8-21-32(22-10-20-31-27)28(34)16-15-24-11-3-1-4-12-24/h1-6,11-16,26,29-30H,7-10,17-23H2,(H,31,33)/b16-15+/t26-/m0/s1
0 references
InChIKey
ASBBGSDFHKCHMP-OXVFXORMSA-N
0 references
PubChem CID
15286484
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
96778012
1 reference
stated in
UniChem
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