Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA010008
PROPERTIES
NPAID | NPA010008 |
---|---|
CLUSTER ID | 3116 |
NODE ID | 2377 |
NAME | Isomalyngamide A |
FORMULA | C29H45ClN2O6 |
MOLECULAR WEIGHT (Da) | 553.1400 |
ACCURATE MASS (Da) | 552.2966 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Lyngbya |
ORIGIN SPECIES | majuscula |
InChIKey | MCGPGUSLTPAGCR-DINDZMPHSA-N |
InChI | InChI=1S/C29H45ClN2O6/c1-6-7-8-9-11-14-24(36-3)15-12-10-13-16-27(33)31(2)21-23(20-30)17-25(37-4)18-28(34)32-22-26(38-5)19-29(32)35/h10,12,18-20,24H,6-9,11,13-17,21-22H2,1-5H3/b12-10+,23-20-,25-18+/t24-/m0/s1 |
SMILES | CCCCCCC[C@@H](C/C=C/CCC(=O)N(C)C/C(=C\Cl)/C/C(=C\C(=O)N1CC(=CC1=O)OC)/OC)OC |
ORIGINAL ISOLATION REFERENCE
CITATION | Kan; Sakamoto; Fujita; Nagai New malyngamides from the Hawaiian cyanobacterium Lyngbya majuscula Journal of Natural Products 2000 63 (12) 1599-1602. | ||
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DOI | 10.1021/np000250t | PMID | 11141095 |