Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000577868 | Gold | 3 |
COMPOUND NPA006308
PROPERTIES
| NPAID | NPA006308 |
|---|---|
| CLUSTER ID | 142 |
| NODE ID | 135 |
| NAME | Clavariopsin B |
| FORMULA | C58H93N9O14 |
| MOLECULAR WEIGHT (Da) | 1140.4310 |
| ACCURATE MASS (Da) | 1139.6842 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Clavariopsis |
| ORIGIN SPECIES | aquatica AJ117363 |
| InChIKey | KPXBYWFZMMXFTN-RKXBODORSA-N |
| InChI | InChI=1S/C58H93N9O14/c1-18-35(11)47-52(73)59-30-42(68)64(14)46(33(7)8)53(74)60-39(28-37-23-25-38(80-17)26-24-37)58(79)81-49(34(9)10)57(78)67-27-21-20-22-40(67)50(71)61-44(31(3)4)51(72)62-45(32(5)6)55(76)63(13)41(29-43(69)70)54(75)66(16)48(36(12)19-2)56(77)65(47)15/h23-26,31-36,39-41,44-49H,18-22,27-30H2,1-17H3,(H,59,73)(H,60,74)(H,61,71)(H,62,72)(H,69,70)/t35-,36-,39-,40-,41-,44-,45-,46-,47-,48-,49+/m0/s1 |
| SMILES | CC[C@H](C)[C@H]1C(=O)NCC(=O)N([C@H](C(=O)N[C@H](C(=O)O[C@@H](C(=O)N2CCCC[C@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N1C)[C@@H](C)CC)C)CC(=O)O)C)C(C)C)C(C)C)C(C)C)CC3=CC=C(C=C3)OC)C(C)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Kaida; Fudou; Kameyama; Tubaki; Suzuki; Ojika; Sakagami New cycle depsipeptide antibiotics, clavariopsins A and B, produce by an aquartic hyphomycetes, Clavariopsis aquatica: 1. Taxonomy, fermentation, isolation, amd biological properties Journal of Antibiotics 2001 54 (1) 17-21. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.54.17 | PMID | 11269710 |
