Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA032824
PROPERTIES
NPAID | NPA032824 |
---|---|
CLUSTER ID | 9484 |
NODE ID | 28 |
NAME | Sesterfisheric acid |
FORMULA | C25H40O3 |
MOLECULAR WEIGHT (Da) | 388.5920 |
ACCURATE MASS (Da) | 388.2977 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Aspergillus |
ORIGIN SPECIES | oryzae |
InChIKey | SLCDJJDPKICHGM-ZIFIXUEUSA-N |
InChI | InChI=1S/C25H40O3/c1-14(2)18-10-11-24(23(26)27)12-21-16(4)7-8-19-15(3)6-9-20(19)17(5)25(21,28)13-22(18)24/h14-16,18-19,21-22,28H,6-13H2,1-5H3,(H,26,27)/b20-17-/t15-,16+,18-,19+,21-,22+,24+,25+/m1/s1 |
SMILES | C/C1=C2\CC[C@@H](C)[C@@H]2CC[C@H](C)[C@H]2C[C@@]3(C(=O)O)CC[C@H](C(C)C)[C@@H]3C[C@]12O |
ORIGINAL ISOLATION REFERENCE
CITATION | Ye, Ying; Minami, Atsushi; Mandi, Attila; Liu, Chengwei; Taniguchi, Tohru; Kuzuyama, Tomohisa; Monde, Kenji; Gomi, Katsuya; Oikawa, Hideaki Genome Mining for Sesterterpenes Using Bifunctional Terpene Synthases Reveals a Unified Intermediate of Di/Sesterterpenes Journal of the American Chemical Society 2015 137 (36) 11846-11853. | ||
---|---|---|---|
DOI | 10.1021/jacs.5b08319 | PMID | 26332841 |