Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA021540
PROPERTIES
| NPAID | NPA021540 |
|---|---|
| CLUSTER ID | 6685 |
| NODE ID | 4635 |
| NAME | Ogipeptin B |
| FORMULA | C44H80N14O11 |
| MOLECULAR WEIGHT (Da) | 981.2110 |
| ACCURATE MASS (Da) | 980.6131 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Pseudoalteromonas |
| ORIGIN SPECIES | sp. SANK 71903 |
| InChIKey | OTQQLALSUYCSEA-ZFEQKBKMSA-N |
| InChI | InChI=1S/C44H80N14O11/c1-5-7-8-9-10-11-12-13-14-17-33(62)56-36-32(61)24-51-41(67)34(30(59)22-46)58-43(69)35(31(60)23-47)57-39(65)27(16-15-20-50-44(48)49)53-40(66)29(21-25(3)4)55-38(64)28(18-19-45)54-37(63)26(6-2)52-42(36)68/h6,11-12,25,27-32,34-36,59-61H,5,7-10,13-24,45-47H2,1-4H3,(H,51,67)(H,52,68)(H,53,66)(H,54,63)(H,55,64)(H,56,62)(H,57,65)(H,58,69)(H4,48,49,50)/b12-11-,26-6?/t27-,28-,29-,30-,31+,32+,34-,35-,36-/m0/s1 |
| SMILES | CCCCCC/C=C\CCCC(=O)N[C@H]1[C@@H](CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C(=CC)NC1=O)CCN)CC(C)C)CCCN=C(N)N)[C@@H](CN)O)[C@H](CN)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Hirota-Takahata, Yuki; Kozuma, Shiho; Kuraya, Nahoki; Fukuda, Daisuke; Nakajima, Mutsuo; Takatsu, Toshio; Ando, Osamu Ogipeptins, novel inhibitors of LPS: Physicochemical properties and structural elucidation Journal of Antibiotics 2017 70 (1) 84-89. | ||
|---|---|---|---|
| DOI | 10.1038/ja.2016.61 | PMID | 27328866 |
