Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA007698
PROPERTIES
| NPAID | NPA007698 |
|---|---|
| CLUSTER ID | 149 |
| NODE ID | 141 |
| NAME | Pholipeptin |
| FORMULA | C64H111N11O20 |
| MOLECULAR WEIGHT (Da) | 1354.6490 |
| ACCURATE MASS (Da) | 1353.8007 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Pseudomonas |
| ORIGIN SPECIES | sp. |
| InChIKey | FIDWFJZZQLPPLI-FRYCLEKBSA-N |
| InChI | InChI=1S/C64H111N11O20/c1-15-17-18-19-20-21-39(78)27-49(79)65-40(22-32(3)4)54(83)69-45(28-50(80)81)59(88)75-53-38(14)95-51(82)29-46(64(93)94)71-62(91)52(37(13)16-2)74-58(87)44(26-36(11)12)68-61(90)48(31-77)73-57(86)42(24-34(7)8)67-60(89)47(30-76)72-56(85)41(23-33(5)6)66-55(84)43(25-35(9)10)70-63(53)92/h32-48,52-53,76-78H,15-31H2,1-14H3,(H,65,79)(H,66,84)(H,67,89)(H,68,90)(H,69,83)(H,70,92)(H,71,91)(H,72,85)(H,73,86)(H,74,87)(H,75,88)(H,80,81)(H,93,94)/t37-,38+,39?,40+,41+,42+,43+,44+,45?,46?,47+,48+,52-,53-/m0/s1 |
| SMILES | CCCCCCCC(CC(=O)N[C@H](CC(C)C)C(=O)NC(CC(=O)O)C(=O)N[C@H]1[C@H](OC(=O)CC(NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@H](NC1=O)CC(C)C)CC(C)C)CO)CC(C)C)CO)CC(C)C)[C@@H](C)CC)C(=O)O)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Ui, Hideaki; Miyake, Toshiaki; Iinuma, Hironobu; Imoto, Masaya; Hattori, Seiko; et al. A NOVEL CYCLIC LIPOUNDECAPEPTIDE, PHOLIPEPTIN, ISOLATED FROM Pseudomonas SP Tetrahedron Letters 1995 36 (41) 7479-7480. | ||
|---|---|---|---|
| DOI | 10.1016/0040-4039(95)01601-5 | PMID | 11588392 |
