Xylarisin
AlkaPlorer ID: AK057495
Synonym: None
IUPAC Name: (1R,4S,8S,9E,11R,12S,14R,15S,16R,17S)-4,8-dihydroxy-15-methyl-17-(2-methylpropyl)-13-oxa-18-azatetracyclo[9.8.0.01,16.012,14]nonadec-9-ene-2,19-dione
Structure
SMILES: CC(C)C[C@@H]1N=C(O)[C@@]23C(=O)C[C@@H](O)CCC[C@H](O)/C=C/[C@H]2[C@@H]2O[C@@H]2[C@@H](C)[C@@H]13
InChI: InChI=1S/C22H33NO5/c1-11(2)9-16-18-12(3)19-20(28-19)15-8-7-13(24)5-4-6-14(25)10-17(26)22(15,18)21(27)23-16/h7-8,11-16,18-20,24-25H,4-6,9-10H2,1-3H3,(H,23,27)/b8-7+/t12-,13-,14-,15-,16-,18-,19+,20-,22+/m0/s1
InChIKey: GNNKACUJOHRGTR-QOYOXESOSA-N
Reference
An [11]Cytochalasin Derivative from the Marine-Derived Fungus Xylaria sp. PSU-F100
PubChem CID: 44607389
LOTUS: LTS0183552
SuperNatural Ⅲ: SN0110459-04
{NPAtlas: NPA003994
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Xylaria sp. | Xylaria | Xylariaceae | Xylariales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 391.508
TPSA？: 102.65
MolLogP？: 2.4282000000000004
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|