19,20-Epoxydeacetylcytochalasin Q
AlkaPlorer ID: AK017217
Synonym: ''
IUPAC Name: (1R,2S,3S,5R,6R,8S,10E,12R,13S,15R,16S,17R,18S)-18-benzyl-2,6-dihydroxy-6,8,15,16-tetramethyl-4,14-dioxa-19-azapentacyclo[10.8.0.01,17.03,5.013,15]icos-10-ene-7,20-dione
Structure
SMILES: C[C@H]1C/C=C/[C@H]2[C@@H]3O[C@]3(C)[C@@H](C)[C@H]3[C@H](CC4=CC=CC=C4)N=C(O)[C@]32[C@H](O)[C@@H]2O[C@H]2[C@@](C)(O)C1=O
InChI: InChI=1S/C28H35NO6/c1-14-9-8-12-17-23-27(4,35-23)15(2)19-18(13-16-10-6-5-7-11-16)29-25(32)28(17,19)22(31)20-24(34-20)26(3,33)21(14)30/h5-8,10-12,14-15,17-20,22-24,31,33H,9,13H2,1-4H3,(H,29,32)/b12-8+/t14-,15-,17-,18-,19-,20-,22+,23-,24+,26-,27+,28-/m0/s1
InChIKey: CROHHODFFQILKQ-GHDXXCIASA-N
Reference
Two new cytotoxic cytochalasins from Xylaria obovata
PubChem CID: 101966699
LOTUS: LTS0079137
SuperNatural Ⅲ: SN0053690-03
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Xylaria obovata | Xylaria | Xylariaceae | Xylariales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 481.58900000000017
TPSA？: 115.18
MolLogP？: 2.6382000000000008
Number of H-Donors: 3
Number of H-Acceptors: 6
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|