Antibiotic A 6067
AlkaPlorer ID: AK288168
Synonym: A 6067
IUPAC Name: [3,4a,8,12b-tetrahydroxy-9-[4-hydroxy-5-[4-hydroxy-5-(5-hydroxy-6-methyloxan-2-yl)oxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]-3-methyl-1,7,12-trioxo-2,4-dihydrobenzo[a]anthracen-5-yl] 2-acetamido-3-sulfanylpropanoate
Structure
SMILES: CC(=O)NC(CS)C(=O)OC1=CC2=C(C(=O)C3=CC=C(C4CC(O)C(OC5CC(O)C(OC6CCC(O)C(C)O6)C(C)O5)C(C)O4)C(O)=C3C2=O)C2(O)C(=O)CC(C)(O)CC12O
InChI: InChI=1S/C42H53NO18S/c1-16-24(45)8-9-30(57-16)60-38-18(3)58-31(12-26(38)47)61-37-17(2)56-27(11-25(37)46)20-6-7-21-32(34(20)49)35(50)22-10-29(59-39(52)23(14-62)43-19(4)44)41(54)15-40(5,53)13-28(48)42(41,55)33(22)36(21)51/h6-7,10,16-18,23-27,30-31,37-38,45-47,49,53-55,62H,8-9,11-15H2,1-5H3,(H,43,44)
InChIKey: SWEJACMLPSTTSD-UHFFFAOYSA-N
Reference
CAS: 139055-90-6
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces griseolus | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 891.9420000000002
TPSA？: 294.36999999999995
MolLogP？: -0.1179999999999976
Number of H-Donors: 9
Number of H-Acceptors: 19
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|