Deacetyl-19,20-epoxy-cytochalasin C
AlkaPlorer ID: AK098259
Synonym: None
IUPAC Name: (1R,2S,3S,5R,6R,8S,10E,12R,13S,16S,17S)-17-benzyl-2,6,13-trihydroxy-6,8,14,15-tetramethyl-4-oxa-18-azatetracyclo[10.7.0.01,16.03,5]nonadeca-10,14-diene-7,19-dione
Structure
SMILES: CC1=C(C)[C@@H]2[C@H](CC3=CC=CC=C3)N=C(O)[C@]23[C@H](O)[C@@H]2O[C@H]2[C@@](C)(O)C(=O)[C@@H](C)C/C=C/[C@H]3[C@@H]1O
InChI: InChI=1S/C28H35NO6/c1-14-9-8-12-18-21(30)16(3)15(2)20-19(13-17-10-6-5-7-11-17)29-26(33)28(18,20)24(32)22-25(35-22)27(4,34)23(14)31/h5-8,10-12,14,18-22,24-25,30,32,34H,9,13H2,1-4H3,(H,29,33)/b12-8+/t14-,18-,19-,20+,21+,22-,24+,25+,27-,28-/m0/s1
InChIKey: PJQNNAWRTWTXKU-MNUVKCIJSA-N
Reference
Cytochalasins and phytotoxins from the fungus Xylaria obovata
PubChem CID: 139587376
LOTUS: LTS0165965
SuperNatural Ⅲ: SN0287198-03
{NPAtlas: NPA015366
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Xylaria obovata | Xylaria | Xylariaceae | Xylariales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 481.5890000000002
TPSA？: 122.88
MolLogP？: 2.5419000000000014
Number of H-Donors: 4
Number of H-Acceptors: 6
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|