Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA005186
PROPERTIES
| NPAID | NPA005186 |
|---|---|
| CLUSTER ID | 442 |
| NODE ID | 400 |
| NAME | TMC-171A |
| FORMULA | C41H72O15 |
| MOLECULAR WEIGHT (Da) | 805.0120 |
| ACCURATE MASS (Da) | 804.4871 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Gliocladium |
| ORIGIN SPECIES | sp. TC 1304 |
| InChIKey | ZDTPAUDBSLWUGF-CYGHGRBGSA-N |
| InChI | InChI=1S/C41H72O15/c1-11-20(2)12-21(3)13-26(8)38(56-41-37(52)36(51)35(50)31(19-44)54-41)27(9)15-24(6)32(47)22(4)14-23(5)33(48)25(7)16-28(10)40(53)55-39(30(46)18-43)34(49)29(45)17-42/h13-16,20-22,25,27,29-39,41-52H,11-12,17-19H2,1-10H3/b23-14+,24-15+,26-13+,28-16+/t20-,21-,22-,25-,27-,29+,30+,31+,32-,33+,34+,35+,36-,37-,38+,39+,41-/m0/s1 |
| SMILES | CC[C@H](C)C[C@H](C)/C=C(\C)/[C@H]([C@@H](C)/C=C(\C)/[C@H]([C@@H](C)/C=C(\C)/[C@H]([C@@H](C)/C=C(\C)/C(=O)O[C@H]([C@@H](CO)O)[C@@H]([C@@H](CO)O)O)O)O)O[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Kohno, Jun; Asai, Yasuyuki; Nishio, Maki; Sakurai, Masaaki; Kawano, Kimio; Hiramatsu, Hajime; Kameda, Noriaki; Kishi, Noboru; Okuda, Toru; Komatsubara, Saburo TMC-171A, B, C and TMC-154, novel polyketide antibiotics produced by Gliocladium sp. TC 1304 and TC 1282 Journal of Antibiotics 1999 52 (12) 1114-1123. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.52.1114 | PMID | 10695675 |
