Mycosporin-Ala
AlkaPlorer ID: AK085070
Synonym: N-[5-Hydroxy-5-(hydroxymethyl)-2-methoxy-3-oxo-1-cyclohexen-1-yl]alanine
IUPAC Name: 2-[[5-hydroxy-5-(hydroxymethyl)-2-methoxy-3-oxocyclohexen-1-yl]amino]propanoic acid
Structure
SMILES: COC1=C(NC(C)C(=O)O)CC(O)(CO)CC1=O
InChI: InChI=1S/C11H17NO6/c1-6(10(15)16)12-7-3-11(17,5-13)4-8(14)9(7)18-2/h6,12-13,17H,3-5H2,1-2H3,(H,15,16)
InChIKey: OXYVYRPLIHACJY-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Colletotrichum graminicola | Colletotrichum | Glomerellaceae | Glomerellales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 259.258
TPSA？: 116.09
MolLogP？: -1.0066000000000002
Number of H-Donors: 4
Number of H-Acceptors: 6
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|