(Q105223041)

English

methyl (1R,12R,13R,14S)-13-(hydroxymethyl)-14-[(Z)-prop-1-enyl]-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraene-13-carboxylate

chemical compound

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Statements

instance of

group of stereoisomers

0 references

subclass of

sarpagine alkaloid

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mass

366.194342692 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₆N₂O₃

0 references

canonical SMILES

O=C(OC)C1(CO)C2N3CCC1(C=CC)CC3C=4NC=5C=CC=CC5C4C2

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isomeric SMILES

C/C=C\[C@]12CCN3[C@H](C1)c1[nH]c4ccccc4c1C[C@@H]3[C@]2(CO)C(=O)OC

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found in taxon

Kopsia arborea

1 reference

stated in

Biologically active indole alkaloids from Kopsia arborea

Identifiers

InChI

InChI=1S/C22H26N2O3/c1-3-8-21-9-10-24-17(12-21)19-15(14-6-4-5-7-16(14)23-19)11-18(24)22(21,13-25)20(26)27-2/h3-8,17-18,23,25H,9-13H2,1-2H3/b8-3-/t17-,18-,21+,22-/m1/s1

0 references

InChIKey

QKDZPXLVEASJMP-JADUBYJLSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QKDZPXLVEASJMP-JADUBYJLSA-N

(Q105223041)

methyl (1R,12R,13R,14S)-13-(hydroxymethyl)-14-[(Z)-prop-1-enyl]-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraene-13-carboxylate

Statements

Identifiers

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