(Q104912140)

English

methyl (1R,11S,12Z,17S)-12-ethylidene-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6,9-tetraene-10-carboxylate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

akuammicine (unspec.)

1 reference

based on heuristic

inferred from SMILES

mass

322.168127944 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

methyl (1R,11R,12E,17S)-12-ethylidene-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6,9-tetraene-10-carboxylate

2 references

based on heuristic

inferred from InChIKey

2 references

inferred from InChIKey

1 reference

C₂₀H₂₂N₂O₂

0 references

canonical SMILES

O=C(OC)C1=C2NC=3C=CC=CC3C24CCN5CC(=CC)C1CC54

0 references

isomeric SMILES

C/C=C1\CN2CC[C@]34C(=C(C(=O)OC)[C@H]1C[C@H]23)Nc1ccccc14

0 references

found in taxon

Alstonia scholaris

1 reference

stated in

Alkaloids of Alstonia scholaris from Thailand

Identifiers

InChI

InChI=1S/C20H22N2O2/c1-3-12-11-22-9-8-20-14-6-4-5-7-15(14)21-18(20)17(19(23)24-2)13(12)10-16(20)22/h3-7,13,16,21H,8-11H2,1-2H3/b12-3+/t13-,16-,20+/m0/s1

0 references

InChIKey

AGZMFTKKLPHOMT-MMAKCWRBSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

AGZMFTKKLPHOMT-MMAKCWRBSA-N

1 reference

(Q104912140)

methyl (1R,11S,12Z,17S)-12-ethylidene-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6,9-tetraene-10-carboxylate

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Identifiers

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