Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA015929
PROPERTIES
NPAID | NPA015929 |
---|---|
CLUSTER ID | 69 |
NODE ID | 64 |
NAME | Poricoic acid CM |
FORMULA | C32H48O4 |
MOLECULAR WEIGHT (Da) | 496.7320 |
ACCURATE MASS (Da) | 496.3553 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Poria |
ORIGIN SPECIES | cocos |
InChIKey | BTOTUPNTIAMSIV-CCQCPENESA-N |
InChI | InChI=1S/C32H48O4/c1-20(2)22(5)10-11-23(29(34)35)25-14-18-32(8)27-13-12-24(21(3)4)30(6,17-16-28(33)36-9)26(27)15-19-31(25,32)7/h13,15,20,23-25H,3,5,10-12,14,16-19H2,1-2,4,6-9H3,(H,34,35)/t23?,24-,25+,30-,31+,32-/m0/s1 |
SMILES | CC(C)C(=C)CCC([C@H]1CC[C@@]2([C@@]1(CC=C3C2=CC[C@H]([C@]3(C)CCC(=O)OC)C(=C)C)C)C)C(=O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Akihisa, Toshihiro; Nakamura, Yuji; Tokuda, Harukuni; Uchiyama, Emiko; Suzuki, Takashi; Kimura, Yumiko; Uchikura, Kazuo; Nishino, Hoyoku Triterpene acids from Poria cocos and their anti-tumor-promoting effects Journal of Natural Products 2007 70 (6) 948-953. | ||
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DOI | 10.1021/np0780001 | PMID | 17488130 |