(Q105161331)

English

(1S,9S,12S,13S,15R,20R)-12-ethyl-8-methyl-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6-triene

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

12-Ethyl-8-methyl-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6-triene

1 reference

based on heuristic

inferred from SMILES

mass

310.204513452 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1R,9R,12R,13S,15R,20S)-12-ethyl-8-methyl-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6-triene

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1S,9S,12R,13S,15R,20S)-12-ethyl-8-methyl-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6-triene

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,9R,12R,13R,15S,20S)-12-ethyl-8-methyl-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6-triene

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₆N₂O

0 references

canonical SMILES

O1C2CN3CCC45C=6C=CC=CC6N(C)C5CCC(CC)(C12)C34

0 references

isomeric SMILES

CC[C@@]12CC[C@@H]3N(C)c4ccccc4[C@@]34CCN(C[C@H]3O[C@H]31)[C@@H]24

0 references

found in taxon

Tabernaemontana divaricata

2 references

stated in

Indole alkaloids from three species of the Ervatamia genus: E. officinalis, E. divaricata, and E. divaricata Gouyahua.

stated in

Alkaloids from Tabernaemontana divaricata

Tabernaemontana bovina

1 reference

stated in

Indole alkaloids from tabernaemontana bovina

Identifiers

InChI

InChI=1S/C20H26N2O/c1-3-19-9-8-16-20(13-6-4-5-7-14(13)21(16)2)10-11-22(18(19)20)12-15-17(19)23-15/h4-7,15-18H,3,8-12H2,1-2H3/t15-,16+,17-,18+,19-,20+/m1/s1

0 references

InChIKey

MCOCUHRVJGWOJQ-FGSPNWDHSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MCOCUHRVJGWOJQ-FGSPNWDHSA-N

1 reference

(Q105161331)

(1S,9S,12S,13S,15R,20R)-12-ethyl-8-methyl-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6-triene

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Identifiers

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