Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA021261
PROPERTIES
| NPAID | NPA021261 |
|---|---|
| CLUSTER ID | 139 |
| NODE ID | 132 |
| NAME | 2-demethylazalomycin F4a |
| FORMULA | C55H93N3O17 |
| MOLECULAR WEIGHT (Da) | 1068.3530 |
| ACCURATE MASS (Da) | 1067.6505 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Unknown-bacterium |
| ORIGIN SPECIES | sp. HIL Y-9120362 |
| InChIKey | AQRJZDXKNNHWLN-QYOSIFBJSA-N |
| InChI | InChI=1S/C55H93N3O17/c1-33-17-13-14-21-50(69)74-52(36(4)18-12-10-8-9-11-15-24-58-54(56)57-7)37(5)20-16-19-34(2)44(62)27-40(60)25-39(59)26-41(73-51(70)31-49(67)68)28-42-29-47(65)53(71)55(72,75-42)32-48(66)35(3)22-23-43(61)38(6)46(64)30-45(33)63/h8-9,13-14,16-17,19-21,33,35-48,52-53,59-66,71-72H,10-12,15,18,22-32H2,1-7H3,(H,67,68)(H3,56,57,58)/b9-8+,17-13+,20-16+,21-14-,34-19+/t33-,35+,36+,37+,38+,39+,40-,41+,42-,43-,44+,45-,46+,47+,48-,52-,53-,55-/m1/s1 |
| SMILES | C[C@H]1CC[C@H]([C@@H]([C@H](C[C@H]([C@@H](/C=C/C=C\C(=O)O[C@@H]([C@H](/C=C/C=C(/[C@H](C[C@@H](C[C@@H](C[C@@H](C[C@@H]2C[C@@H]([C@H]([C@](O2)(C[C@H]1O)O)O)O)OC(=O)CC(=O)O)O)O)O)\C)C)[C@@H](C)CCC/C=C/CCCNC(=NC)N)C)O)O)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Mukhopadhyay T; Vijayakumar EK; Nadkarni SR; Sawant SN; Kenia J; Sachse B 2-DemethylazaIomycins F4a and F5a, Two New Antifungal Metabolites from Actinomycete sp. HIL Y-9120362 Journal of Antibiotics 1995 48 (11) 1350-1352. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.48.1350 | PMID | 8557580 |
