Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA004949
PROPERTIES
| NPAID | NPA004949 |
|---|---|
| CLUSTER ID | 36 |
| NODE ID | 35 |
| NAME | Concentricol |
| FORMULA | C30H54O6 |
| MOLECULAR WEIGHT (Da) | 510.7560 |
| ACCURATE MASS (Da) | 510.3920 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Daldinia |
| ORIGIN SPECIES | concentrica |
| InChIKey | VZNMYFXGBPEORA-VUHAMLAFSA-N |
| InChI | InChI=1S/C30H54O6/c1-23(15-17-27(33)29(5,35)19-9-13-25(3)21-31)11-7-8-12-24(2)16-18-28(34)30(6,36)20-10-14-26(4)22-32/h11-14,27-28,31-36H,7-10,15-22H2,1-6H3/b23-11+,24-12+,25-13+,26-14+ |
| SMILES | C/C(=C\CC/C=C(/CCC(O)C(O)(CC/C=C(/CO)\C)C)\C)/CCC(O)C(O)(CC/C=C(/CO)\C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Stadler, Marc; Baumgartner, Manuela; Grothe, Torsten; Muehlbauer, Andrea; Seip, Stephan; Wollweber, Hartmund Concentricol, a taxonomically significant triterpenoid from Daldinia concentrica Phytochemistry 2001 56 (8) 787-793. | ||
|---|---|---|---|
| DOI | 10.1016/s0031-9422(01)00032-2 | PMID | - |
