Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA006439
PROPERTIES
| NPAID | NPA006439 |
|---|---|
| CLUSTER ID | 442 |
| NODE ID | 400 |
| NAME | Roselipin 2A |
| FORMULA | C42H74O15 |
| MOLECULAR WEIGHT (Da) | 819.0390 |
| ACCURATE MASS (Da) | 818.5028 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Gliocladium |
| ORIGIN SPECIES | roseum (Strain KF-1040) |
| InChIKey | NCIXLNTUPVOTSJ-UTVSEKIBSA-N |
| InChI | InChI=1S/C42H74O15/c1-12-21(2)13-22(3)14-27(8)40(57-42-39(52)38(51)37(50)33(56-42)20-54-30(11)44)28(9)16-25(6)34(47)23(4)15-24(5)35(48)26(7)17-29(10)41(53)55-19-32(46)36(49)31(45)18-43/h15-17,21-23,26-28,31-40,42-43,45-52H,12-14,18-20H2,1-11H3/b24-15+,25-16+,29-17+/t21-,22-,23-,26-,27-,28-,31+,32+,33+,34-,35+,36+,37+,38-,39-,40+,42-/m0/s1 |
| SMILES | CC[C@H](C)C[C@H](C)C[C@H](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)OC[C@H]([C@@H]([C@@H](CO)O)O)O)O)O)O[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)COC(=O)C)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Tomoda, H; Ohyama, Y; Abe, T; Tabata, N; Namikoshi, M; Yamaguchi, Y; Masuma, R; Omura, S Roselipins, inhibitors of diacylglycerol acyltransferase, produced by Gliocladium roseum KF-1040 Journal of Antibiotics 1999 52 (8) 689-694. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.52.815 | PMID | 10580381 |
