Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA004641
PROPERTIES
| NPAID | NPA004641 |
|---|---|
| CLUSTER ID | 1166 |
| NODE ID | 143 |
| NAME | RES-701-2 |
| FORMULA | C103H115N23O24 |
| MOLECULAR WEIGHT (Da) | 2059.1900 |
| ACCURATE MASS (Da) | 2057.8485 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. |
| InChIKey | CXJFFNSFXUKNNN-PAQLRPHSSA-N |
| InChI | InChI=1S/C103H115N23O24/c1-53-102(148)126-34-14-24-81(126)100(146)123-79(45-85(133)109-50-86(134)114-77(43-83(104)131)97(143)119-75(40-60-47-108-69-23-12-10-20-66(60)69)96(142)121-76(42-62-49-106-52-112-62)90(136)111-51-87(135)125-88(54(2)127)101(147)113-53)99(145)120-74(39-59-46-107-68-22-11-9-19-65(59)68)95(141)117-70(35-55-15-5-3-6-16-55)91(137)115-71(36-56-17-7-4-8-18-56)93(139)122-78(44-84(105)132)98(144)118-72(37-57-26-30-63(128)31-27-57)92(138)116-73(38-58-28-32-64(129)33-29-58)94(140)124-80(103(149)150)41-61-48-110-89-67(61)21-13-25-82(89)130/h3-13,15-23,25-33,46-49,52-54,70-81,88,107-108,110,127-130H,14,24,34-45,50-51H2,1-2H3,(H2,104,131)(H2,105,132)(H,106,112)(H,109,133)(H,111,136)(H,113,147)(H,114,134)(H,115,137)(H,116,138)(H,117,141)(H,118,144)(H,119,143)(H,120,145)(H,121,142)(H,122,139)(H,123,146)(H,124,140)(H,125,135)(H,149,150)/t53?,54-,70?,71?,72?,73?,74?,75?,76?,77?,78?,79?,80?,81?,88?/m1/s1 |
| SMILES | CC1C(=O)N2CCCC2C(=O)NC(CC(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)N1)[C@@H](C)O)CC3=CNC=N3)CC4=CNC5=CC=CC=C54)CC(=O)N)C(=O)NC(CC6=CNC7=CC=CC=C76)C(=O)NC(CC8=CC=CC=C8)C(=O)NC(CC9=CC=CC=C9)C(=O)NC(CC(=O)N)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)NC(CC1=CNC2=C1C=CC=C2O)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | OGAWA, TATSUHIRO; OCHIAI, KEIKO; TANAKA, TAKEO; TSUKUDA, Em; CHIBA, SHIGERU; YANO, KEIICHI; YAMASAKI, MOTOO; YOSHIDA, MAYUMI; MATSUDA, YUZURU RES-701-2, -3 and -4, Novel and Selective Endothelin Type B Receptor Antagonists Produced by Streptomyces sp. I. Taxonomy of Producing Strains, Fermentation, Isolation, and Biochemical Properties Journal of Antibiotics 1995 48 (11) 1213-1220. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.48.1213 | PMID | 8557559 |
