Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA003719
PROPERTIES
NPAID | NPA003719 |
---|---|
CLUSTER ID | 69 |
NODE ID | 64 |
NAME | 29-Hydroxydehydropachymic acid |
FORMULA | C33H50O6 |
MOLECULAR WEIGHT (Da) | 542.7570 |
ACCURATE MASS (Da) | 542.3607 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Poria |
ORIGIN SPECIES | cocos |
InChIKey | USCUFHFTPQCOLH-YXMYOOBPSA-N |
InChI | InChI=1S/C33H50O6/c1-19(2)20(3)9-10-22(29(37)38)28-25(36)17-33(8)24-11-12-26-30(5,23(24)13-16-32(28,33)7)15-14-27(39-21(4)35)31(26,6)18-34/h11,13,19,22,25-28,34,36H,3,9-10,12,14-18H2,1-2,4-8H3,(H,37,38)/t22-,25-,26-,27+,28+,30-,31-,32-,33+/m1/s1 |
SMILES | CC(C)C(=C)CC[C@H]([C@H]1[C@@H](C[C@@]2([C@@]1(CC=C3C2=CC[C@@H]4[C@@]3(CC[C@@H]([C@]4(C)CO)OC(=O)C)C)C)C)O)C(=O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Cai, Tian-Ge; Cai, Yu Triterpenes from the Fungus Poria cocos and Their Inhibitory Activity on Nitric Oxide Production in Mouse Macrophages via Blockade of Activating Protein-1 Pathway Chemistry and Biodiversity 2011 8 (11) 2135-2143. | ||
---|---|---|---|
DOI | 10.1002/cbdv.201100013 | PMID | 22083926 |