Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA004801
PROPERTIES
NPAID | NPA004801 |
---|---|
CLUSTER ID | 26 |
NODE ID | 25 |
NAME | Nostocyclopeptide A2 |
FORMULA | C40H54N8O9 |
MOLECULAR WEIGHT (Da) | 790.9190 |
ACCURATE MASS (Da) | 790.4014 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Nostoc |
ORIGIN SPECIES | sp. ATCC53789 |
InChIKey | OYHPNVXZUBWKJE-BZDICHPASA-N |
InChI | InChI=1S/C40H54N8O9/c1-4-24(3)35-39(56)46-31(22-49)40(57)48-21-23(2)16-32(48)38(55)44-27(17-25-8-6-5-7-9-25)19-42-30(18-26-10-12-28(50)13-11-26)36(53)43-20-34(52)45-29(37(54)47-35)14-15-33(41)51/h5-13,19,23-24,27,29-32,35,49-50H,4,14-18,20-22H2,1-3H3,(H2,41,51)(H,43,53)(H,44,55)(H,45,52)(H,46,56)(H,47,54)/t23-,24-,27-,29+,30-,31-,32-,35-/m0/s1 |
SMILES | CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N2C[C@H](C[C@H]2C(=O)N[C@H](C=N[C@H](C(=O)NCC(=O)N[C@@H](C(=O)N1)CCC(=O)N)CC3=CC=C(C=C3)O)CC4=CC=CC=C4)C)CO |
ORIGINAL ISOLATION REFERENCE
CITATION | Golakoti, Trimurtulu; Yoshida, Wesley Y.; Chaganty, Sreedhara; Moore, Richard E. Isolation and structure determination of nostocyclopeptides A1 and A2 from the terrestrial cyanobacterium Nostoc sp. ATCC53789 Journal of Natural Products 2001 64 (1) 54-59. | ||
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DOI | 10.1021/np000316k | PMID | 11170666 |