Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA021072
PROPERTIES
| NPAID | NPA021072 |
|---|---|
| CLUSTER ID | 307 |
| NODE ID | 279 |
| NAME | Deltamycin A3 |
| FORMULA | C41H65NO16 |
| MOLECULAR WEIGHT (Da) | 827.9620 |
| ACCURATE MASS (Da) | 827.4303 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | halstedii subsp. deltae |
| InChIKey | UHJLHWLKXDXMHZ-UIGQCCNPSA-N |
| InChI | InChI=1S/C41H65NO16/c1-11-12-31(46)56-39-24(5)52-33(20-41(39,7)49)57-36-23(4)53-40(35(48)34(36)42(8)9)58-37-26(15-16-43)17-21(2)27(45)13-14-28-29(55-28)18-22(3)51-32(47)19-30(38(37)50-10)54-25(6)44/h13-14,16,21-24,26,28-30,33-40,48-49H,11-12,15,17-20H2,1-10H3/b14-13-/t21-,22+,23-,24+,26-,28-,29+,30+,33-,34-,35-,36-,37+,38-,39+,40+,41+/m0/s1 |
| SMILES | CCCC(=O)O[C@@H]1[C@H](O[C@H](C[C@@]1(C)O)O[C@H]2[C@@H](O[C@@H]([C@H]([C@@H]2N(C)C)O)O[C@@H]3[C@H](C[C@@H](C(=O)/C=C\[C@H]4[C@H](O4)C[C@H](OC(=O)C[C@H]([C@@H]3OC)OC(=O)C)C)C)CC=O)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Shimauchi Y; Kubo K; Osumi K; Okamura K; Fukagawa Y; Ishikura T; Lein J Deltamycins, new macrolide antibiotics. III. Chemical structures. Journal of Antibiotics 1979 32 (9) 878-883. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.32.878 | PMID | 511779 |
