Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA028847
PROPERTIES
| NPAID | NPA028847 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Anacyclamide A9P |
| FORMULA | C52H79N11O16 |
| MOLECULAR WEIGHT (Da) | 1114.2650 |
| ACCURATE MASS (Da) | 1113.5706 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Anabaena |
| ORIGIN SPECIES | sp. 90 |
| InChIKey | AJQSPEKZRLZWLQ-LCQMPJFHSA-N |
| InChI | InChI=1S/C52H79N11O16/c1-27(2)16-19-79-31-14-12-30(13-15-31)22-35-47(73)59-38(25-43(68)69)50(76)60-37(24-42(66)67)49(75)55-32(10-7-8-17-53)44(70)56-33(20-28(3)4)45(71)58-36(23-41(54)65)48(74)57-34(21-29(5)6)46(72)62-39(26-64)52(78)63-18-9-11-40(63)51(77)61-35/h12-16,28-29,32-40,64H,7-11,17-26,53H2,1-6H3,(H2,54,65)(H,55,75)(H,56,70)(H,57,74)(H,58,71)(H,59,73)(H,60,76)(H,61,77)(H,62,72)(H,66,67)(H,68,69)/t32-,33-,34-,35-,36-,37-,38-,39-,40-/m0/s1 |
| SMILES | CC(C)=CCOC1=CC=C(C[C@@H]2NC(=O)[C@@H]3CCCN3C(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC2=O)C=C1 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Leikoski N; Fewer DP; Jokela J; Wahlsten M; Rouhiainen L; Sivonen K Highly diverse cyanobactins in strains of the genus Anabaena. Applied and Environmental Microbiology 2010 76 (3) 701-709. | ||
|---|---|---|---|
| DOI | 10.1128/AEM.01061-09 | PMID | 20008171 |
