Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA012219
PROPERTIES
| NPAID | NPA012219 |
|---|---|
| CLUSTER ID | 279 |
| NODE ID | 253 |
| NAME | Melinacidin IV |
| FORMULA | C30H28N6O8S4 |
| MOLECULAR WEIGHT (Da) | 728.8560 |
| ACCURATE MASS (Da) | 728.0851 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Acrostalagmus |
| ORIGIN SPECIES | cinnabarinus var. melinacidinus |
| InChIKey | VGJIEAUSEFTEPX-GIADBQKFSA-N |
| InChI | InChI=1S/C30H28N6O8S4/c1-33-23(43)29-17(39)27(13-7-3-5-9-15(13)31-19(27)35(29)21(41)25(33,11-37)45-47-29)28-14-8-4-6-10-16(14)32-20(28)36-22(42)26(12-38)34(2)24(44)30(36,18(28)40)48-46-26/h3-10,17-20,31-32,37-40H,11-12H2,1-2H3/t17-,18-,19+,20+,25+,26+,27+,28?,29?,30?/m0/s1 |
| SMILES | CN1C(=O)C23[C@H]([C@]4([C@@H](N2C(=O)[C@]1(SS3)CO)NC5=CC=CC=C54)C67[C@@H](C89C(=O)N([C@@](C(=O)N8[C@H]6NC1=CC=CC=C71)(SS9)CO)C)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Argoudelis, A D; Mizsak, S A Melinacidins II, III and IV. Structural studies Journal of Antibiotics 1977 30 (6) 468-473. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.30.468 | PMID | 885807 |
