21-O-Deacetylcytochalasin Q
AlkaPlorer ID: AK007235
Synonym: None
IUPAC Name: (2R,3Z,5R,7S,9Z,11R,12S,14R,15S,16R,17S)-17-benzyl-2,5-dihydroxy-5,7,14,15-tetramethyl-13-oxa-18-azatetracyclo[9.8.0.01,16.012,14]nonadeca-3,9-diene-6,19-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)C32[C@H](O)/C=C\[C@@](C)(O)C1=O
InChI: InChI=1S/C28H35NO5/c1-16-9-8-12-19-24-27(4,34-24)17(2)22-20(15-18-10-6-5-7-11-18)29-25(32)28(19,22)21(30)13-14-26(3,33)23(16)31/h5-8,10-14,16-17,19-22,24,30,33H,9,15H2,1-4H3,(H,29,32)/b12-8-,14-13-/t16-,17-,19-,20-,21+,22-,24-,26+,27+,28?/m0/s1
InChIKey: RERIIFVZOREWKX-DMYKZJMJSA-N
Reference
New Cytochalasins from the Marine‐Derived Fungus <i>Xylaria</i> sp. SCSIO 156
PubChem CID: 139583129
LOTUS: LTS0157411
{NPAtlas: NPA000163
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Xylaria sp. | Xylaria | Xylariaceae | Xylariales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 465.59000000000015
TPSA？: 102.65
MolLogP？: 3.427000000000002
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|