Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA028474
PROPERTIES
| NPAID | NPA028474 |
|---|---|
| CLUSTER ID | 6511 |
| NODE ID | 141 |
| NAME | Mathermycin |
| FORMULA | C80H116N20O25S3 |
| MOLECULAR WEIGHT (Da) | 1854.1240 |
| ACCURATE MASS (Da) | 1852.7583 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Marinactinospora |
| ORIGIN SPECIES | thermotolerans SCSIO 00652 |
| InChIKey | DNVMJLMJKLCCOS-KSFQLRDRSA-N |
| InChI | InChI=1S/C80H116N20O25S3/c1-9-36(2)56-74(117)86-38(4)64(107)92-52-35-128-41(7)58-77(120)93-51-34-127-42(8)60(78(121)95-56)96-67(110)48(28-44-21-14-11-15-22-44)89-72(115)53-24-18-26-100(53)55(104)31-84-66(109)47(27-43-19-12-10-13-20-43)88-68(111)49(90-70(51)113)29-82-25-17-16-23-46(79(122)123)87-76(119)59(40(6)126-33-45(81)65(108)85-37(3)63(106)91-50(32-101)69(112)97-58)98-75(118)57(39(5)102)94-54(103)30-83-73(116)61(99-71(52)114)62(105)80(124)125/h10-15,19-22,36-42,45-53,56-62,82,101-102,105H,9,16-18,23-35,81H2,1-8H3,(H,83,116)(H,84,109)(H,85,108)(H,86,117)(H,87,119)(H,88,111)(H,89,115)(H,90,113)(H,91,106)(H,92,107)(H,93,120)(H,94,103)(H,95,121)(H,96,110)(H,97,112)(H,98,118)(H,99,114)(H,122,123)(H,124,125)/t36-,37-,38-,39-,40+,41+,42?,45-,46-,47-,48-,49-,50-,51-,52+,53-,56-,57-,58-,59?,60-,61-,62+/m0/s1 |
| SMILES | CC[C@H](C)[C@@H]1NC(=O)[C@H]2NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@@H]3CCCN3C(=O)CNC(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@@H]3CNCCCC[C@@H](C(=O)O)NC(=O)C4NC(=O)[C@H]([C@H](C)O)NC(=O)CNC(=O)[C@H]([C@@H](O)C(=O)O)NC(=O)[C@@H](CS[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](N)CS[C@@H]4C)C(=O)N[C@@H](CSC2C)C(=O)N3)NC(=O)[C@H](C)NC1=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Chen E; Chen Q; Chen S; Xu B; Ju J; Wang H Mathermycin, a Lantibiotic from the Marine Actinomycete Marinactinospora thermotolerans SCSIO 00652. Applied and Environmental Microbiology 2017 83 (15) e00926-17. | ||
|---|---|---|---|
| DOI | 10.1128/AEM.00926-17 | PMID | 28576760 |
