(11)-Cytochalasa-5,13,19-triene-l,21-dione-7-hydroperoxy-17-hydroxy-16,18-dimethyl-10-phenyl-(5Z*,7S*,13E,16S*,17R*,18S*,19E)
AlkaPlorer ID: AK103529
Synonym: None
IUPAC Name: (1S,3E,5R,6S,7R,9E,11S,12R,15S,16R)-16-benzyl-12-hydroperoxy-6-hydroxy-5,7,13,14-tetramethyl-17-azatricyclo[9.7.0.01,15]octadeca-3,9,13-triene-2,18-dione
Structure
SMILES: CC1=C(C)[C@H](OO)[C@H]2/C=C/C[C@@H](C)[C@H](O)[C@H](C)/C=C/C(=O)[C@@]23C(=O)N[C@H](CC2=CC=CC=C2)[C@@H]13
InChI: InChI=1S/C28H35NO5/c1-16-9-8-12-21-26(34-33)19(4)18(3)24-22(15-20-10-6-5-7-11-20)29-27(32)28(21,24)23(30)14-13-17(2)25(16)31/h5-8,10-14,16-17,21-22,24-26,31,33H,9,15H2,1-4H3,(H,29,32)/b12-8+,14-13+/t16-,17-,21-,22-,24-,25+,26+,28+/m1/s1
InChIKey: YZMKUCUMIIGSIT-BPPJWCPBSA-N
Reference
Cytochalasins from a Daldinia sp. of fungus
PubChem CID: 139587095
LOTUS: LTS0105905
SuperNatural Ⅲ: SN0464445-03
{NPAtlas: NPA014410
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Daldinia sp. | Daldinia | Hypoxylaceae | Xylariales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 465.5900000000002
TPSA？: 95.86
MolLogP？: 3.8728000000000025
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|