Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA019615
PROPERTIES
| NPAID | NPA019615 |
|---|---|
| CLUSTER ID | 1344 |
| NODE ID | 572 |
| NAME | Brasilinolide A |
| FORMULA | C57H98O24 |
| MOLECULAR WEIGHT (Da) | 1167.3870 |
| ACCURATE MASS (Da) | 1166.6448 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Nocardia |
| ORIGIN SPECIES | brasiliensis |
| InChIKey | MVSIZSYJQDRVAV-LJIRPTLYSA-N |
| InChI | InChI=1S/C57H98O24/c1-9-10-16-46(67)78-44-25-49(76-34(8)52(44)72)75-33(7)29(3)50(70)30(4)51(71)31(5)53-32(6)54-55(80-54)41(62)15-12-14-39(77-48(69)26-45(65)66)22-38(61)23-40-24-42(63)56(73)57(74,81-40)27-43(64)28(2)18-19-36(59)21-37(60)20-35(58)13-11-17-47(68)79-53/h11,17,28-44,49-56,58-64,70-74H,9-10,12-16,18-27H2,1-8H3,(H,65,66)/b17-11+/t28?,29?,30?,31?,32?,33?,34-,35?,36?,37?,38?,39?,40-,41?,42+,43?,44-,49+,50?,51?,52+,53?,54?,55?,56-,57+/m1/s1 |
| SMILES | CCCCC(=O)O[C@@H]1C[C@H](O[C@@H]([C@@H]1O)C)OC(C)C(C)C(C(C)C(C(C)C2C(C3C(O3)C(CCCC(CC(C[C@@H]4C[C@@H]([C@H]([C@@](O4)(CC(C(CCC(CC(CC(C/C=C/C(=O)O2)O)O)O)C)O)O)O)O)O)OC(=O)CC(=O)O)O)C)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Tanaka, Yasushi; Komaki, Hisayuki; Yazawa, Katsukiyo; Mikami, Yuzuru; Nemoto, Akira; Tojyo, Takashi; Kadowaki, Kiyoshi; Shigemori, Hideyuki; Kobayashi, Jun'ichi Brasilinolide A, a new macrolide antibiotic produced by Nocardia brasiliensis: Producing strain, isolation and biological activity Journal of Antibiotics 1997 50 (12) 1036-1041. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.50.1036 | PMID | 9510911 |
