Ilicifoliunine B
AlkaPlorer ID: AK001500
Synonym: None
IUPAC Name: [(1S,3R,18S,19R,20R,21R,22S,23S,24R,25R,26S)-19,20,22,25-tetraacetyloxy-21-(acetyloxymethyl)-26-hydroxy-3,15,26-trimethyl-6,16-dioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.01,21.03,24.07,12]hexacosa-7(12),8,10-trien-23-yl] benzoate
Structure
SMILES: CC1CCC2=C(C=CC=N2)C(=O)OC[C@]3([C@@H]4[C@@H]([C@H]([C@@]5([C@H]([C@H]([C@@H]([C@]([C@]5([C@@H]4OC(=O)C)O3)(C)O)OC1=O)OC(=O)C)OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C6=CC=CC=C6)C
InChI: InChI=1S/C43H49NO18/c1-21-16-17-29-28(15-12-18-44-29)39(52)55-19-40(7)30-31(60-38(51)27-13-10-9-11-14-27)35(58-25(5)48)42(20-54-22(2)45)36(59-26(6)49)32(56-23(3)46)34(61-37(21)50)41(8,53)43(42,62-40)33(30)57-24(4)47/h9-15,18,21,30-36,53H,16-17,19-20H2,1-8H3/t21?,30-,31+,32+,33-,34+,35-,36+,40+,41+,42-,43+/m1/s1
InChIKey: KQXQAVDCTYNZCX-PULGNUSDSA-N
Reference
Antiprotozoal Sesquiterpene Pyridine Alkaloids from <i>Maytenus ilicifolia</i>
PubChem CID: 59051621
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Monteverdia ilicifolia | Monteverdia | Celastraceae | Celastrales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 867.854
TPSA？: 252.74999999999994
MolLogP？: 2.1565000000000047
Number of H-Donors: 1
Number of H-Acceptors: 19
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Leishmania amazonensis | Leishmania amazonensis | Activity | None | None | 10.1021/np300077r |
| Leishmania chagasi | Leishmania chagasi | Activity | None | None | 10.1021/np300077r |
| Trypanosoma cruzi | Trypanosoma cruzi | Activity | None | None | 10.1021/np300077r |