Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA016836
PROPERTIES
NPAID | NPA016836 |
---|---|
CLUSTER ID | 26 |
NODE ID | 25 |
NAME | Nostophycin |
FORMULA | C46H64N8O10 |
MOLECULAR WEIGHT (Da) | 889.0640 |
ACCURATE MASS (Da) | 888.4745 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Nostoc |
ORIGIN SPECIES | sp. 152 |
InChIKey | UQSINWJOXDSXPH-XHECVERBSA-N |
InChI | InChI=1S/C46H64N8O10/c1-3-28(2)39-46(64)54-24-12-20-36(54)44(62)50-33(26-31(55)18-10-17-29-13-6-4-7-14-29)40(58)45(63)49-32(21-22-37(47)56)41(59)48-27-38(57)53-23-11-19-35(53)43(61)51-34(42(60)52-39)25-30-15-8-5-9-16-30/h4-9,13-16,28,31-36,39-40,55,58H,3,10-12,17-27H2,1-2H3,(H2,47,56)(H,48,59)(H,49,63)(H,50,62)(H,51,61)(H,52,60)/t28-,31-,32-,33-,34+,35+,36+,39-,40+/m1/s1 |
SMILES | CC[C@@H](C)[C@@H]1C(=O)N2CCC[C@H]2C(=O)N[C@@H]([C@@H](C(=O)N[C@@H](C(=O)NCC(=O)N3CCC[C@H]3C(=O)N[C@H](C(=O)N1)CC4=CC=CC=C4)CCC(=O)N)O)C[C@@H](CCCC5=CC=CC=C5)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Fujii, Kiyonaga; Sivonen, Kaarina; Kashiwagi, Tatsuki; Hirayama, Kazuo; Harada, Ken-Ichi Nostophycin, a novel cyclic peptide from the toxic Cyanobacterium Nostoc sp. 152 Journal of Organic Chemistry 1999 64 (16) 5777-5782. | ||
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DOI | 10.1021/jo982306i | PMID | - |