Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA019756
PROPERTIES
NPAID | NPA019756 |
---|---|
CLUSTER ID | 69 |
NODE ID | 64 |
NAME | Poricoic acid CE |
FORMULA | C33H50O4 |
MOLECULAR WEIGHT (Da) | 510.7590 |
ACCURATE MASS (Da) | 510.3709 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Poria |
ORIGIN SPECIES | cocos |
InChIKey | PMJATQUJKYISSR-DBJVCEQOSA-N |
InChI | InChI=1S/C33H50O4/c1-10-37-29(34)17-18-31(7)25(22(4)5)13-14-28-27(31)16-20-32(8)26(15-19-33(28,32)9)24(30(35)36)12-11-23(6)21(2)3/h14,16,21,24-26H,4,6,10-13,15,17-20H2,1-3,5,7-9H3,(H,35,36)/t24-,25+,26-,31+,32-,33+/m1/s1 |
SMILES | CCOC(=O)CC[C@]1([C@@H](CC=C2C1=CC[C@]3([C@]2(CC[C@@H]3[C@@H](CCC(=C)C(C)C)C(=O)O)C)C)C(=C)C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Yang, Chun-Hua; Zhang, Shi-Fang; Liu, Wen-Ying; Zhang, Zun-Jian; Liu, Jing-Han Two New Triterpenes from the Surface Layer of Poria cocos Helvetica Chimica Acta 2009 92 (4) 660-667. | ||
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DOI | 10.1002/hlca.200800360 | PMID | - |