(1S,2R,3S,4R)-5-cyano-1,2,3,7-tetrahydroxy-3-methyl-6,11-dioxo-1H,2H,4H-benzo[b]carbazol-4-yl 2-methylpropanoate
AlkaPlorer ID: AK259509
Synonym: None
IUPAC Name: [(1S,2R,3S,4R)-5-cyano-1,2,3,7-tetrahydroxy-3-methyl-6,11-dioxo-2,4-dihydro-1H-benzo[h]carbazol-4-yl] 2-methylpropanoate
Structure
SMILES: CC(C)C(=O)O[C@@H]1C2=C(C3=C(C(=O)C4=C(O)C=CC=C4C3=O)N2C#N)[C@H](O)[C@@H](O)[C@]1(C)O
InChI: InChI=1S/C22H20N2O8/c1-8(2)21(30)32-20-15-13(18(28)19(29)22(20,3)31)12-14(24(15)7-23)17(27)11-9(16(12)26)5-4-6-10(11)25/h4-6,8,18-20,25,28-29,31H,1-3H3/t18-,19+,20+,22-/m0/s1
InChIKey: JXVISNKVWBRMFM-HIUFNZKISA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces chattanoogensis | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 440.4080000000001
TPSA？: 170.07999999999998
MolLogP？: 0.6974799999999999
Number of H-Donors: 4
Number of H-Acceptors: 10
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|