Tentoxin
AlkaPlorer ID: AK069793
Synonym: None
IUPAC Name: (3S,6S,12Z)-12-benzylidene-1,6,7-trimethyl-3-(2-methylpropyl)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
Structure
SMILES: CC(C)C[C@@H]1N=C(O)[C@H](C)N(C)C(=O)CN=C(O)/C(=C/C2=CC=CC=C2)N(C)C1=O
InChI: InChI=1S/C22H30N4O4/c1-14(2)11-17-22(30)26(5)18(12-16-9-7-6-8-10-16)21(29)23-13-19(27)25(4)15(3)20(28)24-17/h6-10,12,14-15,17H,11,13H2,1-5H3,(H,23,29)(H,24,28)/b18-12-/t15-,17-/m0/s1
InChIKey: SIIRBDOFKDACOK-LFXZBHHUSA-N
Reference
PubChem CID: 5281143
CAS: 28540-82-1
LOTUS: LTS0192594
SuperNatural Ⅲ: SN0346299-04
{NPAtlas: NPA032752
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Alternaria porri | Alternaria | Pleosporaceae | Pleosporales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 414.5060000000001
TPSA？: 105.8
MolLogP？: 2.674100000000001
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|