(11)-Cytochalasa-6(12),13-diene-1,21-dione-16,18-dimethyl-7-hydroxy-lO-phenyl-(7S*,13E,16S*,18S*)
AlkaPlorer ID: AK100186
Synonym: None
IUPAC Name: (1S,5R,7S,9E,11S,12R,14R,15S,16R)-16-benzyl-12-hydroxy-5,7,14-trimethyl-13-methylidene-17-azatricyclo[9.7.0.01,15]octadec-9-ene-2,18-dione
Structure
SMILES: C=C1[C@H](C)[C@@H]2[C@@H](CC3=CC=CC=C3)N=C(O)[C@@]23C(=O)CC[C@@H](C)C[C@H](C)C/C=C/[C@@H]3[C@H]1O
InChI: InChI=1S/C28H37NO3/c1-17-9-8-12-22-26(31)20(4)19(3)25-23(16-21-10-6-5-7-11-21)29-27(32)28(22,25)24(30)14-13-18(2)15-17/h5-8,10-12,17-19,22-23,25-26,31H,4,9,13-16H2,1-3H3,(H,29,32)/b12-8+/t17-,18-,19+,22-,23-,25-,26+,28+/m1/s1
InChIKey: PTFNSBGUGCYQFN-NWKGAVBNSA-N
Reference
Cytochalasins from a Daldinia sp. of fungus
PubChem CID: 139586260
LOTUS: LTS0039756
SuperNatural Ⅲ: SN0294549-02
{NPAtlas: NPA011402
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Daldinia sp. | Daldinia | Hypoxylaceae | Xylariales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 435.6080000000002
TPSA？: 69.89
MolLogP？: 5.324900000000006
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|