Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00006434471 | Gold | 1 |
| CCMSLIB00006434512 | Gold | 1 |
| CCMSLIB00006434592 | Gold | 1 |
| CCMSLIB00006491519 | Gold | 1 |
| CCMSLIB00006490845 | Gold | 1 |
| CCMSLIB00006490872 | Gold | 1 |
| CCMSLIB00006490901 | Gold | 1 |
| CCMSLIB00006490929 | Gold | 1 |
| CCMSLIB00006490930 | Gold | 1 |
| CCMSLIB00006490957 | Gold | 1 |
| CCMSLIB00006490958 | Gold | 1 |
| CCMSLIB00006490986 | Gold | 1 |
| CCMSLIB00006491390 | Gold | 1 |
| CCMSLIB00006491411 | Gold | 1 |
| CCMSLIB00006491412 | Gold | 1 |
| CCMSLIB00006491441 | Gold | 1 |
| CCMSLIB00006491442 | Gold | 1 |
| CCMSLIB00006491468 | Gold | 1 |
| CCMSLIB00006491494 | Gold | 1 |
| CCMSLIB00006491876 | Gold | 1 |
| CCMSLIB00006491898 | Gold | 1 |
| CCMSLIB00006491899 | Gold | 1 |
| CCMSLIB00006491914 | Gold | 1 |
| CCMSLIB00006491954 | Gold | 1 |
| CCMSLIB00006492368 | Gold | 1 |
| CCMSLIB00006492392 | Gold | 1 |
| CCMSLIB00006492737 | Gold | 1 |
| CCMSLIB00006492800 | Gold | 1 |
COMPOUND NPA009271
PROPERTIES
| NPAID | NPA009271 |
|---|---|
| CLUSTER ID | 69 |
| NODE ID | 64 |
| NAME | Poricoic acid A |
| FORMULA | C31H46O5 |
| MOLECULAR WEIGHT (Da) | 498.7040 |
| ACCURATE MASS (Da) | 498.3345 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Poria |
| ORIGIN SPECIES | cocos |
| InChIKey | KVAQLXUMUVEKGR-SMFZDKLCSA-N |
| InChI | InChI=1S/C31H46O5/c1-18(2)20(5)9-10-21(28(35)36)27-25(32)17-31(8)24-12-11-22(19(3)4)29(6,15-14-26(33)34)23(24)13-16-30(27,31)7/h12-13,18,21-22,25,27,32H,3,5,9-11,14-17H2,1-2,4,6-8H3,(H,33,34)(H,35,36)/t21-,22+,25-,27+,29+,30-,31+/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]([C@]3(C)CCC(=O)O)C(=C)C)C)C)O)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Tai, Takaaki; Akahori, Akira; Shingu, Tetsuro Triterpenoids from Poria cocos Phytochemistry 1991 30 (8) 2796-2797. | ||
|---|---|---|---|
| DOI | 10.1016/0031-9422(91)85149-t | PMID | - |
