Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA010245
PROPERTIES
| NPAID | NPA010245 |
|---|---|
| CLUSTER ID | 3476 |
| NODE ID | 163 |
| NAME | Strophasterol B |
| FORMULA | C28H44O4 |
| MOLECULAR WEIGHT (Da) | 444.6560 |
| ACCURATE MASS (Da) | 444.3240 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Stropharia |
| ORIGIN SPECIES | rugosoannulata |
| InChIKey | ULYVEOOCGBYFBH-DLJLLTRWSA-N |
| InChI | InChI=1S/C28H44O4/c1-15(2)16(3)13-18-7-8-20(17(18)4)26(5)11-10-21-22(24(26)31)23(30)25-28(32-25)14-19(29)9-12-27(21,28)6/h15-20,23,25,29-30H,7-14H2,1-6H3/t16?,17?,18?,19-,20+,23+,25-,26+,27+,28-/m0/s1 |
| SMILES | CC1[C@@H](CCC1CC(C)C(C)C)[C@]2(CCC3=C(C2=O)[C@H]([C@H]4[C@@]5([C@@]3(CC[C@@H](C5)O)C)O4)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Wu, Jing; Tokuyama, Shinji; Nagai, Kaoru; Yasuda, Nobuhiro; Noguchi, Keiichi; Matsumoto, Tetsuo; Hirai, Hirofumi; Kawagishi, Hirokazu Strophasterols A to D with an Unprecedented Steroid Skeleton: From the Mushroom Stropharia rugosoannulata Angewandte Chemie 2012 124 (43) 10978-10980. | ||
|---|---|---|---|
| DOI | 10.1002/ange.201205351 | PMID | 23012134 |
