Berninamycin A; 6''',10'''-Dihydro
AlkaPlorer ID: AK290544
Synonym: Berninamycin E
IUPAC Name: None
Structure
SMILES: C=C1NC(=O)C2=C(C)OC(=N2)C(=C)NC(=O)C(C(C)(C)O)NC(=O)C(=C)NC(=O)C2=C(C)OC(=N2)/C(=C\C)NC(=O)C(C(C)O)NC(=O)C2=CSC(=N2)C2=CC=C(C(=O)NC(=C)C(=O)NC(C)C(N)=O)N=C2C2=COC(=N2)C(=C)NC1=O
InChI: InChI=1S/C51H53N15O15S/c1-13-28-49-65-34(26(10)81-49)45(76)56-21(5)40(71)66-36(51(11,12)78)46(77)58-23(7)48-64-33(25(9)80-48)44(75)55-20(4)39(70)57-22(6)47-61-30(16-79-47)35-27(50-62-31(17-82-50)42(73)63-32(24(8)67)43(74)60-28)14-15-29(59-35)41(72)54-19(3)38(69)53-18(2)37(52)68/h13-18,24,32,36,67,78H,3-7H2,1-2,8-12H3,(H2,52,68)(H,53,69)(H,54,72)(H,55,75)(H,56,76)(H,57,70)(H,58,77)(H,60,74)(H,63,73)(H,66,71)/b28-13+
InChIKey: HUECQTAVYSKOEK-XODNFHPESA-N
Reference
CAS: 1454689-47-4
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces atroolivaceus | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 1148.142
TPSA？: 449.3199999999998
MolLogP？: -0.0268599999999913
Number of H-Donors: 12
Number of H-Acceptors: 21
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|