Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA002052
PROPERTIES
NPAID | NPA002052 |
---|---|
CLUSTER ID | 1267 |
NODE ID | 1074 |
NAME | Integracin B |
FORMULA | C35H54O7 |
MOLECULAR WEIGHT (Da) | 586.8100 |
ACCURATE MASS (Da) | 586.3870 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Cytonaema |
ORIGIN SPECIES | sp. |
InChIKey | IKNYNBVDLOWJFN-UHFFFAOYSA-N |
InChI | InChI=1S/C35H54O7/c1-3-15-28(36)19-13-9-6-8-12-18-27-23-31(39)25-33(40)34(27)35(41)42-32(16-4-2)20-14-10-5-7-11-17-26-21-29(37)24-30(38)22-26/h21-25,28,32,36-40H,3-20H2,1-2H3 |
SMILES | CCCC(CCCCCCCC1=CC(=CC(=C1C(=O)OC(CCC)CCCCCCCC2=CC(=CC(=C2)O)O)O)O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Singh, Sheo B.; Zink, Deborah L.; Bills, Gerald F.; Pelaez, Fernando; Teran, Ana; Collado, Javier; Silverman, Keith C.; Lingham, Russell B.; Felock, Peter; Hazuda, Daria J. Discovery, structure and HIV-1 integrase inhibitory activities of integracins, novel dimeric alkyl aromatics from Cytonaema sp Tetrahedron Letters 2002 43 (9) 1617-1620. | ||
---|---|---|---|
DOI | 10.1016/s0040-4039(02)00083-7 | PMID | - |