(2E)-N-[(2S)-1-[(1R,9R,10S,11R,12R)-1,12-dihydroxy-3,5-dimethoxy-9-(4-methoxyphenyl)-10-phenyl-8-oxatricyclo[7.2.1.0²,⁷]dodeca-2(7),3,5-triene-11-carbonyl]pyrrolidin-2-yl]-2-methylbut-2-enamide
AlkaPlorer ID: AK551552
Synonym: None
IUPAC Name: N-[1-[1,12-dihydroxy-3,5-dimethoxy-9-(4-methoxyphenyl)-10-phenyl-8-oxatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-11-carbonyl]pyrrolidin-2-yl]-2-methylbut-2-enamide
Structure
SMILES: CC=C(C)C(O)=NC1CCCN1C(=O)C1C(C2=CC=CC=C2)C2(C3=CC=C(OC)C=C3)OC3=CC(OC)=CC(OC)=C3C1(O)C2O
InChI: InChI=1S/C36H40N2O8/c1-6-21(2)32(39)37-28-13-10-18-38(28)33(40)31-29(22-11-8-7-9-12-22)36(23-14-16-24(43-3)17-15-23)34(41)35(31,42)30-26(45-5)19-25(44-4)20-27(30)46-36/h6-9,11-12,14-17,19-20,28-29,31,34,41-42H,10,13,18H2,1-5H3,(H,37,39)
InChIKey: VRXIZYQZACJUDE-UHFFFAOYSA-N
Reference
Cytotoxic Constituents from Leaves of <i>Aglaia elliptifolia</i>
PubChem CID: 73108331
CAS: 319917-12-9
LOTUS: LTS0148458
COCONUT: CNP0224304.4
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aglaia elliptifolia | Aglaia | Meliaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 628.7220000000003
TPSA？: 130.28000000000003
MolLogP？: 4.833600000000006
Number of H-Donors: 3
Number of H-Acceptors: 8
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|