Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000577840 | Gold | 3 |
COMPOUND NPA014039
PROPERTIES
| NPAID | NPA014039 |
|---|---|
| CLUSTER ID | 142 |
| NODE ID | 135 |
| NAME | Clavariopsin A |
| FORMULA | C59H95N9O14 |
| MOLECULAR WEIGHT (Da) | 1154.4580 |
| ACCURATE MASS (Da) | 1153.6998 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Clavariopsis |
| ORIGIN SPECIES | aquatica AJ117363 |
| InChIKey | ALFBBRGNEWVYDN-DLXPCLOVSA-N |
| InChI | InChI=1S/C59H95N9O14/c1-19-36(11)48-51(72)60-31-43(69)64(14)46(33(5)6)52(73)61-40(29-38-24-26-39(81-18)27-25-38)59(80)82-50(35(9)10)58(79)68-28-22-21-23-41(68)54(75)65(15)47(34(7)8)53(74)62-45(32(3)4)56(77)63(13)42(30-44(70)71)55(76)67(17)49(37(12)20-2)57(78)66(48)16/h24-27,32-37,40-42,45-50H,19-23,28-31H2,1-18H3,(H,60,72)(H,61,73)(H,62,74)(H,70,71)/t36-,37-,40-,41-,42-,45-,46-,47-,48-,49-,50+/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)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 |
