Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA003689
PROPERTIES
| NPAID | NPA003689 |
|---|---|
| CLUSTER ID | 2015 |
| NODE ID | 143 |
| NAME | Streptomonomicin |
| FORMULA | C107H160N22O30 |
| MOLECULAR WEIGHT (Da) | 2234.5810 |
| ACCURATE MASS (Da) | 2233.1671 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomonospora |
| ORIGIN SPECIES | alba |
| InChIKey | ZUTGGQMQIWDJCW-BCPYKWEZSA-N |
| InChI | InChI=1S/C107H160N22O30/c1-16-57(12)86(124-95(146)72-47-82(137)113-75(50-130)96(147)116-67(40-53(4)5)90(141)110-49-84(139)114-76(51-131)97(148)122-77(52-132)106(157)128-38-20-23-79(128)99(150)119-70(43-61-25-31-64(133)32-26-61)92(143)117-71(46-81(108)136)93(144)118-72)101(152)120-68(41-54(6)7)91(142)109-48-83(138)112-73(44-62-27-33-65(134)34-28-62)104(155)127-37-19-22-78(127)98(149)111-60(15)89(140)115-69(42-55(8)9)94(145)125-88(59(14)18-3)103(154)123-85(56(10)11)100(151)126-87(58(13)17-2)102(153)121-74(45-63-29-35-66(135)36-30-63)105(156)129-39-21-24-80(129)107(158)159/h25-36,53-60,67-80,85-88,130-135H,16-24,37-52H2,1-15H3,(H2,108,136)(H,109,142)(H,110,141)(H,111,149)(H,112,138)(H,113,137)(H,114,139)(H,115,140)(H,116,147)(H,117,143)(H,118,144)(H,119,150)(H,120,152)(H,121,153)(H,122,148)(H,123,154)(H,124,146)(H,125,145)(H,126,151)(H,158,159)/t57-,58-,59-,60-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-,85-,86-,87-,88-/m0/s1 |
| SMILES | CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N2CCC[C@H]2C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC3=CC=C(C=C3)O)C(=O)N4CCC[C@H]4C(=O)O)NC(=O)[C@@H]5CC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N6CCC[C@H]6C(=O)N[C@H](C(=O)N[C@H](C(=O)N5)CC(=O)N)CC7=CC=C(C=C7)O)CO)CO)CC(C)C)CO |
ORIGINAL ISOLATION REFERENCE
| CITATION | Metelev, Mikhail; Tietz, Jonathan I.; Melby, Joel O.; Blair, Patricia M.; Zhu, Lingyang; Livnat, Itamar; Severinov, Konstantin; Mitchell, Douglas A. Structure, bioactivity, and resistance mechanism of streptomonomicin, an unusual lasso peptide from an understudied halophilic actinomycete Chemistry & Biology 2015 22 (2) 241-250. | ||
|---|---|---|---|
| DOI | 10.1016/j.chembiol.2014.11.017 | PMID | 25601074 |
