Cytochalasin Z20
AlkaPlorer ID: AK091922
Synonym: None
IUPAC Name: (1aS,2S,2aS,5S,5aS,6S,6aR)-5-benzyl-2a-hydroxy-2-[(E,4S,6S)-6-hydroxy-4-methyl-5-oxohept-1-enyl]-6,6a-dimethyl-1a,2,4,5,5a,6-hexahydrooxireno[2,3-f]isoindol-3-one
Structure
SMILES: C[C@H](O)C(=O)[C@@H](C)C/C=C/[C@H]1[C@@H]2O[C@]2(C)[C@@H](C)[C@H]2[C@H](CC3=CC=CC=C3)N=C(O)[C@]21O
InChI: InChI=1S/C25H33NO5/c1-14(21(28)16(3)27)9-8-12-18-22-24(4,31-22)15(2)20-19(26-23(29)25(18,20)30)13-17-10-6-5-7-11-17/h5-8,10-12,14-16,18-20,22,27,30H,9,13H2,1-4H3,(H,26,29)/b12-8+/t14-,15-,16-,18-,19-,20-,22-,24+,25+/m0/s1
InChIKey: NBVORADFJOAZAV-HFUIFYSESA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus flavipes | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
| Acanthus ilicifolius | Acanthus | Acanthaceae | Lamiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 427.54100000000017
TPSA？: 102.65
MolLogP？: 2.8708000000000005
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | A2780 | Activity | None | None | 10.1021/acs.jnatprod.0c00344 |