Deacetylsirodesmin Pl
AlkaPlorer ID: AK040640
Synonym: None
IUPAC Name: (1R,3S,4S,5S,5'R,7R,10R)-3,4-dihydroxy-10-(hydroxymethyl)-4',4',5',14-tetramethylspiro[11,12-dithia-8,14-diazatetracyclo[8.2.2.01,8.03,7]tetradecane-5,2'-oxolane]-3',9,13-trione
Structure
SMILES: C[C@H]1O[C@]2(C[C@H]3N4C(=O)[C@@]5(CO)SS[C@]4(C[C@@]3(O)[C@@H]2O)C(=O)N5C)C(=O)C1(C)C
InChI: InChI=1S/C18H24N2O7S2/c1-8-14(2,3)10(22)16(27-8)5-9-15(26,11(16)23)6-17-12(24)19(4)18(7-21,29-28-17)13(25)20(9)17/h8-9,11,21,23,26H,5-7H2,1-4H3/t8-,9-,11+,15+,16-,17-,18-/m1/s1
InChIKey: ODGGLAWTFMFKDG-DKTCTLHISA-N
Reference
Minor phytotoxins from the blackleg fungus Phoma lingam
PubChem CID: 15608380
LOTUS: LTS0059356
SuperNatural Ⅲ: SN0262294-01
NPASS: NPC88943
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 444.5310000000002
TPSA？: 127.61
MolLogP？: -0.9122999999999994
Number of H-Donors: 3
Number of H-Acceptors: 9
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Brassica juncea | Brassica juncea | Activity | nan | None | 10.1016/j.bmc.2008.07.060 |
| Brassica juncea | Brassica juncea | FC | 8.0 | None | 10.1016/j.bmc.2008.07.060 |
| Brassica napus | Brassica napus | Activity | nan | None | 10.1016/j.bmc.2008.07.060 |
| Brassica napus | Brassica napus | FC | 8.0 | None | 10.1016/j.bmc.2008.07.060 |