Milbemycins α28
AlkaPlorer ID: AK029509
Synonym: 'Milbemycins α28', 'milbemycin alpha28'
IUPAC Name: [(1R,3'R,4S,4'S,5'R,6S,6'R,8R,10Z,13R,14Z,16Z,20R,21R,24S)-3',21,24-trihydroxy-5',6',11,13-tetramethyl-4'-(2-methylbutanoyloxy)-2-oxospiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-22-yl]methyl 1H-pyrrole-2-carboxylate
Structure
SMILES: CCC(C)C(=O)O[C@H]1[C@H](C)[C@@H](C)O[C@@]2(C[C@@H]3C[C@@H](C/C=C(/C)C[C@@H](C)/C=C\C=C4\CO[C@@H]5[C@H](O)C(COC(=O)C6=CC=CN6)=C[C@@H](C(=O)O3)[C@]45O)O2)[C@@H]1O
InChI: InChI=1S/C41H55NO12/c1-7-24(4)37(45)52-34-25(5)26(6)53-40(35(34)44)19-30-18-29(54-40)14-13-23(3)16-22(2)10-8-11-28-21-49-36-33(43)27(17-31(38(46)51-30)41(28,36)48)20-50-39(47)32-12-9-15-42-32/h8-13,15,17,22,24-26,29-31,33-36,42-44,48H,7,14,16,18-21H2,1-6H3/b10-8-,23-13-,28-11-/t22-,24?,25+,26+,29+,30-,31-,33+,34-,35+,36+,40+,41+/m0/s1
InChIKey: LFQNVDAPCWUUFS-SGRPJTFUSA-N
Reference
Further New Milbemycin Antibiotics from Streptomyces bingchenggensis
PubChem CID: 139586512
LOTUS: LTS0207337
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces bingchenggensis | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 753.8860000000004
TPSA？: 183.07
MolLogP？: 4.238000000000005
Number of H-Donors: 4
Number of H-Acceptors: 12
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|