(Q105157065)

English

methyl (1S,11S,17R,18R)-18-[(1S)-1-methoxyethyl]-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

19S-Methoxytubotaiwine

1 reference

based on heuristic

inferred from SMILES

mass

354.194342692 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

19(R)-methoxytubotaiwine

1 reference

based on heuristic

inferred from InChI

19(S)-methoxytubotaiwine

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₁H₂₆N₂O₃

0 references

canonical SMILES

O=C(OC)C1=C2NC=3C=CC=CC3C24CCN5CCC1C(C(OC)C)C54

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isomeric SMILES

COC(=O)C1=C2Nc3ccccc3[C@]23CCN2CC[C@H]1[C@@H]([C@H](C)OC)[C@@H]23

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found in taxon

Kopsia arborea

1 reference

stated in

Biologically active indole alkaloids from Kopsia arborea

Identifiers

InChI

InChI=1S/C21H26N2O3/c1-12(25-2)16-13-8-10-23-11-9-21(19(16)23)14-6-4-5-7-15(14)22-18(21)17(13)20(24)26-3/h4-7,12-13,16,19,22H,8-11H2,1-3H3/t12-,13-,16+,19+,21+/m0/s1

0 references

InChIKey

LTOOPESWVADEAE-VUKHWUTDSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LTOOPESWVADEAE-VUKHWUTDSA-N

(Q105157065)

methyl (1S,11S,17R,18R)-18-[(1S)-1-methoxyethyl]-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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