Ostreogrycin B; N-De-Me
AlkaPlorer ID: AK308790
Synonym: Efepristin, Ostreogrycin Z2, Ostreogrycin B2, Vernamycin Bβ, Pristinamycin IB, Antibiotic E 129Z2, Antibiotic RP 13919, E 129Z2, RP 13919
IUPAC Name: N-[3-[[4-(dimethylamino)phenyl]methyl]-12-ethyl-16-methyl-2,5,11,14,18,21,24-heptaoxo-19-phenyl-17-oxa-1,4,10,13,20-pentazatricyclo[20.4.0.06,10]hexacosan-15-yl]-3-hydroxypyridine-2-carboxamide
Structure
SMILES: CCC1NC(=O)C(NC(=O)C2=NC=CC=C2O)C(C)OC(=O)C(C2=CC=CC=C2)NC(=O)C2CC(=O)CCN2C(=O)C(CC2=CC=C(N(C)C)C=C2)NC(=O)C2CCCN2C1=O
InChI: InChI=1S/C44H52N8O10/c1-5-30-42(59)51-21-10-13-32(51)38(55)47-31(23-26-15-17-28(18-16-26)50(3)4)43(60)52-22-19-29(53)24-33(52)39(56)49-36(27-11-7-6-8-12-27)44(61)62-25(2)35(40(57)46-30)48-41(58)37-34(54)14-9-20-45-37/h6-9,11-12,14-18,20,25,30-33,35-36,54H,5,10,13,19,21-24H2,1-4H3,(H,46,57)(H,47,55)(H,48,58)(H,49,56)
InChIKey: HESKXMPGUHYWGA-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces pristinaespiralis | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
| Streptomyces ostreogriseus | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 852.9459999999997
TPSA？: 236.75
MolLogP？: 0.9278000000000068
Number of H-Donors: 5
Number of H-Acceptors: 12
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|