(3S,4S,6R,7R)-9-cyano-3,13-dihydroxy-6-methyl-11,18-dioxo-5-oxa-9-azapentacyclo[8.8.0.0²,⁸.0⁴,⁶.0¹²,¹⁷]octadeca-1(10),2(8),12(17),13,15-pentaen-7-yl 2-methylpropanoate
AlkaPlorer ID: AK071103
Synonym: None
IUPAC Name: [(3S,4S,6R,7R)-9-cyano-3,13-dihydroxy-6-methyl-11,18-dioxo-5-oxa-9-azapentacyclo[8.8.0.02,8.04,6.012,17]octadeca-1(10),2(8),12(17),13,15-pentaen-7-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]2O[C@]12C
InChI: InChI=1S/C22H18N2O7/c1-8(2)21(29)30-19-15-13(18(28)20-22(19,3)31-20)12-14(24(15)7-23)17(27)11-9(16(12)26)5-4-6-10(11)25/h4-6,8,18-20,25,28H,1-3H3/t18-,19+,20-,22+/m0/s1
InChIKey: WMTZPTDZOUFHEI-CUXKYVRBSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces chattanoogensis | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 422.39300000000014
TPSA？: 142.15
MolLogP？: 1.74308
Number of H-Donors: 2
Number of H-Acceptors: 9
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|