Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA008334
PROPERTIES
| NPAID | NPA008334 |
|---|---|
| CLUSTER ID | 3576 |
| NODE ID | 163 |
| NAME | (24E)-3,4-hydroxycucurbita-5,24-diene-26-oic acid |
| FORMULA | C30H48O3 |
| MOLECULAR WEIGHT (Da) | 456.7110 |
| ACCURATE MASS (Da) | 456.3603 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Russula |
| ORIGIN SPECIES | lepida |
| InChIKey | JMOPTHLWCJXLBX-MTPQQZNSSA-N |
| InChI | InChI=1S/C30H48O3/c1-19(9-8-10-20(2)26(32)33)21-15-16-30(7)24-13-11-22-23(12-14-25(31)27(22,3)4)28(24,5)17-18-29(21,30)6/h10-11,19,21,23-25,31H,8-9,12-18H2,1-7H3,(H,32,33)/b20-10+/t19-,21-,23-,24-,25+,28+,29-,30+/m1/s1 |
| SMILES | C[C@H](CC/C=C(\C)/C(=O)O)[C@H]1CC[C@@]2([C@@]1(CC[C@@]3([C@H]2CC=C4[C@H]3CC[C@@H](C4(C)C)O)C)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Jian-Wen, Tan; Ze-Jun, Dong; Ji-Kai, Liu New Terpenoids from Basidiomycetes Russula lepida Helvetica Chimica Acta 2000 83 (12) 3191-3197. | ||
|---|---|---|---|
| DOI | 10.1002/1522-2675(20001220)83:12<3191::aid-hlca3191>3.0.co;2-v | PMID | - |
