Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA016083
PROPERTIES
| NPAID | NPA016083 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Lyngbyazothrin A |
| FORMULA | C62H96N12O19 |
| MOLECULAR WEIGHT (Da) | 1313.5150 |
| ACCURATE MASS (Da) | 1312.6915 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Lyngbya |
| ORIGIN SPECIES | sp. |
| InChIKey | ACFCYNJDAMJVRV-NPTOQFMUSA-N |
| InChI | InChI=1S/C62H96N12O19/c1-8-33(5)50-58(88)69-42(31-75)55(85)65-38(9-2)54(84)71-51(34(6)76)59(89)67-40(21-18-35-16-19-37(93-7)20-17-35)61(91)73-25-10-13-43(73)56(86)68-41(28-36(77)29-47(79)46(78)27-32(3)4)52(82)60(90)66-39(22-23-48(63)80)53(83)64-30-49(81)72-24-12-15-45(72)62(92)74-26-11-14-44(74)57(87)70-50/h9,16-17,19-20,32-34,36,39-47,50-52,75-79,82H,8,10-15,18,21-31H2,1-7H3,(H2,63,80)(H,64,83)(H,65,85)(H,66,90)(H,67,89)(H,68,86)(H,69,88)(H,70,87)(H,71,84)/b38-9+/t33-,34+,36?,39-,40?,41?,42-,43-,44-,45-,46?,47?,50+,51-,52?/m0/s1 |
| SMILES | CC[C@H](C)[C@@H]1C(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)N[C@H](C(=O)NC(C(=O)N2CCC[C@H]2C(=O)NC(C(C(=O)N[C@H](C(=O)NCC(=O)N3CCC[C@H]3C(=O)N4CCC[C@H]4C(=O)N1)CCC(=O)N)O)CC(CC(C(CC(C)C)O)O)O)CCC5=CC=C(C=C5)OC)[C@@H](C)O)CO |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zainuddin, Elmi N.; Jansen, Rolf; Nimtz, Manfred; Wray, Victor; Preisitsch, Michael; Lalk, Michael; Mundt, Sabine Lyngbyazothrins A-D, antimicrobial cyclic undecapeptides from the cultured cyanobacterium Lyngbya sp Journal of Natural Products 2009 72 (8) 1373-1378. | ||
|---|---|---|---|
| DOI | 10.1021/np8007792 | PMID | 19621877 |
