Colletopyrandione
AlkaPlorer ID: AK292848
Synonym: 3-(1,3-Dihydro-3-hydroxy-3-methyl-2H-indol-2-ylidene)-5,6-dimethyl-2H-pyran-2,4(3H)-dione
IUPAC Name: 4-hydroxy-3-(3-hydroxy-3-methylindol-2-yl)-5,6-dimethylpyran-2-one
Structure
SMILES: CC1=C(C)C(=O)C(=C2NC3=CC=CC=C3C2(C)O)C(=O)O1
InChI: InChI=1S/C16H15NO4/c1-8-9(2)21-15(19)12(13(8)18)14-16(3,20)10-6-4-5-7-11(10)17-14/h4-7,17,20H,1-3H3
InChIKey: JJZKOTSWTXBMAA-UHFFFAOYSA-N
Reference
CAS: 2148921-50-8
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Colletotrichum higginsianum | Colletotrichum | Glomerellaceae | Glomerellales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 285.29900000000004
TPSA？: 75.63000000000001
MolLogP？: 1.9935000000000005
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|