Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA015585
PROPERTIES
NPAID | NPA015585 |
---|---|
CLUSTER ID | 2403 |
NODE ID | 1891 |
NAME | Erythromycin B |
FORMULA | C37H67NO12 |
MOLECULAR WEIGHT (Da) | 717.9380 |
ACCURATE MASS (Da) | 717.4663 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Streptomyces |
ORIGIN SPECIES | erythreus |
InChIKey | IDRYSCOQVVUBIJ-PPGFLMPOSA-N |
InChI | InChI=1S/C37H67NO12/c1-14-26-20(4)29(40)21(5)28(39)18(2)16-36(9,44)33(50-35-30(41)25(38(11)12)15-19(3)46-35)22(6)31(23(7)34(43)48-26)49-27-17-37(10,45-13)32(42)24(8)47-27/h18-27,29-33,35,40-42,44H,14-17H2,1-13H3/t18-,19-,20+,21+,22+,23-,24+,25+,26-,27+,29+,30-,31+,32+,33-,35+,36-,37-/m1/s1 |
SMILES | CC[C@@H]1[C@@H]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Wiley, Paul F; Sigal Jr, Max V; Weaver, Ollidene; Monahan, Rosmarie; Gerzon, Koert Erythromycin. XI. 1 Structure of Erythromycin B2 Journal of the American Chemical Society 1957 79 (22) 6070-6074. | ||
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DOI | 10.1021/ja01579a060 | PMID | - |