Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA014042
PROPERTIES
| NPAID | NPA014042 |
|---|---|
| CLUSTER ID | 283 |
| NODE ID | 257 |
| NAME | Spumigin C |
| FORMULA | C30H40N6O8 |
| MOLECULAR WEIGHT (Da) | 612.6840 |
| ACCURATE MASS (Da) | 612.2908 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Nodularia |
| ORIGIN SPECIES | spumigena AV1 |
| InChIKey | JCBBIZWYSLCGPJ-ZTRUVXPPSA-N |
| InChI | InChI=1S/C30H40N6O8/c31-30(32)33-15-1-3-23(29(43)44)35-26(40)24-4-2-16-36(24)28(42)22(14-9-18-5-10-20(37)11-6-18)34-27(41)25(39)17-19-7-12-21(38)13-8-19/h5-8,10-13,22-25,37-39H,1-4,9,14-17H2,(H,34,41)(H,35,40)(H,43,44)(H4,31,32,33)/t22-,23?,24+,25-/m1/s1 |
| SMILES | C1C[C@H](N(C1)C(=O)[C@@H](CCC2=CC=C(C=C2)O)NC(=O)[C@@H](CC3=CC=C(C=C3)O)O)C(=O)NC(CCCN=C(N)N)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Kiyonaga, Fujii; Sivonen, Kaarina; Adachi, Kyoko; Noguchi, Kazuyoshi; Sano, Hiroshi; et al. Comparative Study of Toxic and Non-toxic Cyanobacterial Products: Novel Peptides from Toxic Nodularia spumigena AV1 Tetrahedron Letters 1997 38 (31) 5525-5528. | ||
|---|---|---|---|
| DOI | 10.1016/s0040-4039(97)01192-1 | PMID | - |
