(Q27138406)

Macrophylline A (English)

methyl (Z)-2-[(3R,5'S,6'R,7'S,8'aS)-6'-ethyl-2-oxo-5'-(2-oxopropyl)spiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl]-3-methoxyprop-2-enoate

7 October 2016

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

methyl (Z)-2-[(3S,5'S,6'R,7'S,8'aS)-6'-ethyl-2-oxo-5'-(2-oxopropyl)spiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl]-3-methoxyprop-2-enoate

1 reference

1 reference

C₂₅H₃₂N₂O₅

1 reference

Macrophylline A (English)

7 October 2016

canonical SMILES

CCC1C(CC2C3(CCN2C1CC(=O)C)C4=CC=CC=C4NC3=O)C(=COC)C(=O)OC

1 reference

Macrophylline A (English)

7 October 2016

isomeric SMILES

CC[C@@H]1[C@H](C[C@H]2[C@@]3(CCN2[C@H]1CC(=O)C)C4=CC=CC=C4NC3=O)/C(=C\OC)/C(=O)OC

1 reference

Macrophyllionium and macrophyllines A and B, oxindole alkaloids from Uncaria macrophylla

Macrophylline A (English)

7 October 2016

1 reference

Identifiers

InChI

InChI=1S/C25H32N2O5/c1-5-16-17(18(14-31-3)23(29)32-4)13-22-25(10-11-27(22)21(16)12-15(2)28)19-8-6-7-9-20(19)26-24(25)30/h6-9,14,16-17,21-22H,5,10-13H2,1-4H3,(H,26,30)/b18-14+/t16-,17+,21+,22+,25-/m1/s1

1 reference

Macrophylline A (English)

VWNYHBABHBBFQC-QFEVCRBPSA-N

7 October 2016

InChIKey

2 references

Macrophylline A (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

Methyl (7beta,16E,20alpha,21beta)-16-(methoxymethylene)-2-oxo-21-(2-oxopropyl)corynoxan-17-oate (English)

7 October 2016

2 references

Macrophylline A (English)

matched by identifier from

7 October 2016

InChIKey

VWNYHBABHBBFQC-QFEVCRBPSA-N

ChEBI ID

70067

mapping relation type

2 references

Macrophylline A (English)