Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA006071
PROPERTIES
| NPAID | NPA006071 |
|---|---|
| CLUSTER ID | 2900 |
| NODE ID | 143 |
| NAME | Curvopeptin-5 |
| FORMULA | C113H173N25O31S2 |
| MOLECULAR WEIGHT (Da) | 2441.9050 |
| ACCURATE MASS (Da) | 2440.2171 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Thermomonospora |
| ORIGIN SPECIES | curvata |
| InChIKey | SEXSCYXNSYPMAA-UHFFFAOYSA-N |
| InChI | InChI=1S/C113H173N25O31S2/c1-55(2)35-70(113(168)169)44-86(140)82-51-170-53-84(109(164)123-65(18)97(152)129-79(43-69-31-25-22-26-32-69)100(155)121-66(19)98(153)138-92(67(20)139)111(166)134-74(37-57(5)6)101(156)124-71(48-116-82)36-56(3)4)137-112(167)93(148)73(42-68-29-23-21-24-30-68)127-99(154)72(33-27-28-34-114)126-107(162)81(46-91(146)147)133-110(165)85-54-171-52-83(135-104(159)78(41-61(13)14)132-106(161)80(45-90(144)145)125-89(143)50-118-88(142)49-117-87(141)47-115)108(163)122-63(16)95(150)119-62(15)94(149)120-64(17)96(151)128-75(38-58(7)8)102(157)130-76(39-59(9)10)103(158)131-77(40-60(11)12)105(160)136-85/h21-26,29-32,55-62,65,67,70-85,92,116,139H,16-17,19,27-28,33-54,114-115H2,1-15,18,20H3,(H,117,141)(H,118,142)(H,119,150)(H,120,149)(H,121,155)(H,122,163)(H,123,164)(H,124,156)(H,125,143)(H,126,162)(H,127,154)(H,128,151)(H,129,152)(H,130,157)(H,131,158)(H,132,161)(H,133,165)(H,134,166)(H,135,159)(H,136,160)(H,137,167)(H,138,153)(H,144,145)(H,146,147)(H,168,169) |
| SMILES | CC1C(=O)NC(C(=O)NC(=C)C(=O)NC(C(=O)NC(C(=O)NC(CNC(CSCC(C(=O)N1)NC(=O)C(=O)C(CC2=CC=CC=C2)NC(=O)C(CCCCN)NC(=O)C(CC(=O)O)NC(=O)C3CSCC(C(=O)NC(=C)C(=O)NC(C(=O)NC(=C)C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N3)CC(C)C)CC(C)C)CC(C)C)C)NC(=O)C(CC(C)C)NC(=O)C(CC(=O)O)NC(=O)CNC(=O)CNC(=O)CN)C(=O)CC(CC(C)C)C(=O)O)CC(C)C)CC(C)C)C(C)O)CC4=CC=CC=C4 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Krawczyk, Bartlomiej; Völler, Ginka H.; Völler, Jan; Ensle, Paul; Süssmuth, Roderich D. Curvopeptin: A New Lanthionine-Containing Class III Lantibiotic and its Co-substrate Promiscuous Synthetase ChemBioChem 2012 13 (14) 2065-2071. | ||
|---|---|---|---|
| DOI | 10.1002/cbic.201200417 | PMID | 22907786 |
