(Q105349663)

English

(1S,13R,14S,15E)-15-ethylidene-13-methyl-11-aza-1-azoniapentacyclo[12.2.2.01,13.04,12.05,10]octadeca-4(12),5,7,9-tetraene

chemical compound

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instance of

type of chemical entity

0 references

subclass of

alkaloid

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mass

279.18557515609 dalton

1 reference

1 reference

inferred from InChIKey

chemical formula

C₁₉H₂₃N₂⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C=1C=CC2=C(C1)NC3=C2CC[N+]45CC(=CC)C(CC4)C35C

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isomeric SMILES

C/C=C1/C[N@+]23CCc4c([nH]c5ccccc45)[C@@]2(C)[C@H]1CC3

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found in taxon

Aspidosperma subincanum

1 reference

stated in

Subincanadines A-C, novel quaternary indole alkaloids from Aspidosperma subincanum

Identifiers

InChI

InChI=1S/C19H23N2/c1-3-13-12-21-10-8-15-14-6-4-5-7-17(14)20-18(15)19(21,2)16(13)9-11-21/h3-7,16,20H,8-12H2,1-2H3/q+1/b13-3-/t16-,19+,21+/m0/s1

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InChIKey

YKFXXRDKXYTPFL-OHEBUFIDSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YKFXXRDKXYTPFL-OHEBUFIDSA-N

1 reference

(Q105349663)

(1S,13R,14S,15E)-15-ethylidene-13-methyl-11-aza-1-azoniapentacyclo[12.2.2.01,13.04,12.05,10]octadeca-4(12),5,7,9-tetraene

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Identifiers

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