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(Q117835382)
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English
Novacine
group of stereoisomers with the chemical formula C₂₂H₂₆N₂O₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
382.189257312
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₂₆N₂O₄
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canonical SMILES
O=C(OCC1(C(=O)OC)C=2NC=3C=CC=CC3C2CN4CC(=CC)C1CC4)C
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isomeric SMILES
C/C=C1/CN2CC[C@@H]1[C@](COC(C)=O)(C(=O)OC)c1[nH]c3ccccc3c1C2
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found in taxon
Tabernaemontana dichotoma
1 reference
stated in
Tertiary indole alkaloids from fruits of Tabernaemontana dichotoma.
Tabernaemontana alternifolia
1 reference
stated in
Chemotaxonomic study of the genusTabernaemontana (Apocynaceae) based on their indole alkaloid content
Alstonia angustiloba
1 reference
stated in
Angustilobine and andranginine type indole alkaloids and an uleine-secovallesamine bisindole alkaloid from Alstonia angustiloba.
Identifiers
InChI
InChI=1S/C22H26N2O4/c1-4-15-11-24-10-9-18(15)22(21(26)27-3,13-28-14(2)25)20-17(12-24)16-7-5-6-8-19(16)23-20/h4-8,18,23H,9-13H2,1-3H3/b15-4-/t18-,22-/m0/s1
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InChIKey
FFOLRDAPZBOCPV-MNOLJAKZSA-N
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