Antibiotic A 32390A
AlkaPlorer ID: AK288213
Synonym: 1,6-Di-O-(2-isocyano-3-methylcrotonyl)-D-mannitol, A 32390A
IUPAC Name: [2,3,4,5-tetrahydroxy-6-(2-isocyano-3-methylbut-2-enoyl)oxyhexyl] 2-isocyano-3-methylbut-2-enoate
Structure
SMILES: [C-]#[N+]C(C(=O)OCC(O)C(O)C(O)C(O)COC(=O)C([N+]#[C-])=C(C)C)=C(C)C
InChI: InChI=1S/C18H24N2O8/c1-9(2)13(19-5)17(25)27-7-11(21)15(23)16(24)12(22)8-28-18(26)14(20-6)10(3)4/h11-12,15-16,21-24H,7-8H2,1-4H3
InChIKey: YEMJVHOPMVQUGS-UHFFFAOYSA-N
Reference
A32390A, a new biologically active metabolite. II. Isolation and structure.
PubChem CID: 43589
CAS: 61241-59-6
LOTUS: LTS0160574
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Pyrenochaeta | Cucurbitariaceae | Pleosporales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 396.3960000000002
TPSA？: 142.24000000000004
MolLogP？: -0.0572200000000009
Number of H-Donors: 4
Number of H-Acceptors: 8
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|