Cytochalasin Q; 19β,20β-Epoxide
AlkaPlorer ID: AK294195
Synonym: 19,20-Epoxycytochalasin Q
IUPAC Name: (18-benzyl-6-hydroxy-6,8,15,16-tetramethyl-7,20-dioxo-4,14-dioxa-19-azapentacyclo[10.8.0.01,17.03,5.013,15]icos-10-en-2-yl) acetate
Structure
SMILES: CC(=O)OC1C2OC2C(C)(O)C(=O)C(C)CC=CC2C3OC3(C)C(C)C3C(CC4=CC=CC=C4)N=C(O)C213
InChI: InChI=1S/C30H37NO7/c1-15-10-9-13-19-24-29(5,38-24)16(2)21-20(14-18-11-7-6-8-12-18)31-27(34)30(19,21)26(36-17(3)32)22-25(37-22)28(4,35)23(15)33/h6-9,11-13,15-16,19-22,24-26,35H,10,14H2,1-5H3,(H,31,34)
InChIKey: GSPOYKSHFNFUKI-UHFFFAOYSA-N
Reference
Citocalasinas produzidas por Xylaria sp., um fungo endofítico de Piper aduncum (piperaceae)
PubChem CID: 73698941
CAS: 156098-31-6
LOTUS: LTS0272127
COCONUT: CNP0369331.7
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Xylaria sp. | Xylaria | Xylariaceae | Xylariales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
| Xylaria obovata | Xylaria | Xylariaceae | Xylariales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 523.6260000000002
TPSA？: 121.25
MolLogP？: 3.2090000000000005
Number of H-Donors: 2
Number of H-Acceptors: 7
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|