Depsilairdin
AlkaPlorer ID: AK294883
Synonym: None
IUPAC Name: (4-hydroxy-4,8a-dimethyl-6-prop-1-en-2-yl-1,2,3,4a,5,6,7,8-octahydronaphthalen-1-yl) 3,4-dihydroxy-1-[2-[[2-[(2-hydroxy-3-methylbutanoyl)-methylamino]-3-methylbutanoyl]-methylamino]-3-methylbutanoyl]-3-methylpyrrolidine-2-carboxylate
Structure
SMILES: C=C(C)C1CCC2(C)C(OC(=O)C3N(C(=O)C(C(C)C)N(C)C(=O)C(C(C)C)N(C)C(=O)C(O)C(C)C)CC(O)C3(C)O)CCC(C)(O)C2C1
InChI: InChI=1S/C38H65N3O9/c1-20(2)24-14-16-36(9)25(18-24)37(10,48)17-15-27(36)50-35(47)31-38(11,49)26(42)19-41(31)33(45)29(22(5)6)39(12)32(44)28(21(3)4)40(13)34(46)30(43)23(7)8/h21-31,42-43,48-49H,1,14-19H2,2-13H3
InChIKey: IWUVZHGEHIQGEQ-UHFFFAOYSA-N
Reference
Phomapyrones: Three metabolites from the blackleg fungus
PubChem CID: 72982175
LOTUS: LTS0202506
COCONUT: CNP0244034.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Leptosphaeria | Leptosphaeriaceae | Pleosporales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 707.95
TPSA？: 168.14999999999998
MolLogP？: 2.747300000000004
Number of H-Donors: 4
Number of H-Acceptors: 9
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|