Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA004691
PROPERTIES
NPAID | NPA004691 |
---|---|
CLUSTER ID | 69 |
NODE ID | 64 |
NAME | Ganoderic acid TR |
FORMULA | C30H44O4 |
MOLECULAR WEIGHT (Da) | 468.6780 |
ACCURATE MASS (Da) | 468.3240 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Ganoderma |
ORIGIN SPECIES | lucidum |
InChIKey | SNZQBBATMLGADX-QGPJMSCKSA-N |
InChI | InChI=1S/C30H44O4/c1-18(9-8-10-19(2)26(33)34)22-17-25(32)30(7)21-11-12-23-27(3,4)24(31)14-15-28(23,5)20(21)13-16-29(22,30)6/h10-11,13,18,22-23,25,32H,8-9,12,14-17H2,1-7H3,(H,33,34)/t18-,22-,23+,25+,28-,29-,30-/m1/s1 |
SMILES | C[C@H](CCC=C(C)C(=O)O)[C@H]1C[C@@H]([C@@]2([C@@]1(CC=C3C2=CC[C@@H]4[C@@]3(CCC(=O)C4(C)C)C)C)C)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Liu, Jie; Kurashiki, Kenji; Shimizu, Kuniyoshi; Kondo, Ryuichiro Structure-activity relationship for inhibition of 5alpha-reductase by triterpenoids isolated from Ganoderma lucidum Bioorganic and Medicinal Chemistry 2006 14 (24) 8654-8660. | ||
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DOI | 10.1016/j.bmc.2006.08.018 | PMID | 16962782 |