Supprescin A
AlkaPlorer ID: AK080406
Synonym: None
IUPAC Name: 2-[[2-[[3-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-aminopropanoyl]amino]-3-hydroxypropanoyl]amino]acetic acid
Structure
SMILES: CC(=O)NC1C(OCC(N)C(=O)NC(CO)C(=O)NCC(=O)O)OC(CO)C(O)C1O
InChI: InChI=1S/C16H28N4O11/c1-6(23)19-11-13(27)12(26)9(4-22)31-16(11)30-5-7(17)14(28)20-8(3-21)15(29)18-2-10(24)25/h7-9,11-13,16,21-22,26-27H,2-5,17H2,1H3,(H,18,29)(H,19,23)(H,20,28)(H,24,25)
InChIKey: NDZJFHZGBBVUQM-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Mycosphaerella | Mycosphaerellaceae | Mycosphaerellales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 452.41700000000014
TPSA？: 250.0
MolLogP？: -6.048099999999997
Number of H-Donors: 9
Number of H-Acceptors: 11
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|