Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA010156
PROPERTIES
| NPAID | NPA010156 |
|---|---|
| CLUSTER ID | 2836 |
| NODE ID | 2187 |
| NAME | Polymyxin-P1 |
| FORMULA | C54H94N16O14 |
| MOLECULAR WEIGHT (Da) | 1191.4440 |
| ACCURATE MASS (Da) | 1190.7135 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Bacillus |
| ORIGIN SPECIES | polymyxa |
| InChIKey | YKYJELXCEPRFPA-ZIEZDPLUSA-N |
| InChI | InChI=1S/C54H94N16O14/c1-6-29(2)12-10-11-15-41(74)61-34(16-22-55)49(79)69-43(31(4)72)53(83)66-37(19-25-58)46(76)64-39-21-27-60-52(82)42(30(3)71)68-50(80)38(20-26-59)63-45(75)36(18-24-57)65-54(84)44(32(5)73)70-51(81)40(28-33-13-8-7-9-14-33)67-47(77)35(17-23-56)62-48(39)78/h7-9,13-14,29-32,34-40,42-44,71-73H,6,10-12,15-28,55-59H2,1-5H3,(H,60,82)(H,61,74)(H,62,78)(H,63,75)(H,64,76)(H,65,84)(H,66,83)(H,67,77)(H,68,80)(H,69,79)(H,70,81)/t29-,30?,31?,32?,34?,35?,36?,37?,38?,39?,40?,42?,43?,44?/m0/s1 |
| SMILES | CC[C@H](C)CCCCC(=O)NC(CCN)C(=O)NC(C(C)O)C(=O)NC(CCN)C(=O)NC1CCNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC1=O)CCN)CC2=CC=CC=C2)C(C)O)CCN)CCN)C(C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Kimura, Y; Murai, E; Fujisawa, M; Tatsuki, T; Nobue, F Polymyxin P, new antibiotics of polymyxin group Journal of Antibiotics 1969 22 (9) 449-450. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.22.449 | PMID | 4391193 |
