Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA010115
PROPERTIES
NPAID | NPA010115 |
---|---|
CLUSTER ID | 69 |
NODE ID | 64 |
NAME | Ergosta-7,22-dien-3beta-yl palmitate |
FORMULA | C44H76O2 |
MOLECULAR WEIGHT (Da) | 637.0900 |
ACCURATE MASS (Da) | 636.5845 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Ganoderma |
ORIGIN SPECIES | amboinense |
InChIKey | FNQWAQSWCDRWDH-KIPQSSDWSA-N |
InChI | InChI=1S/C44H76O2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-42(45)46-37-28-30-43(6)36(32-37)24-25-38-40-27-26-39(44(40,7)31-29-41(38)43)35(5)23-22-34(4)33(2)3/h22-23,25,33-37,39-41H,8-21,24,26-32H2,1-7H3/b23-22+/t34-,35+,36?,37-,39+,40?,41?,43-,44+/m0/s1 |
SMILES | CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2(C3CC[C@@]4([C@H](CCC4C3=CCC2C1)[C@H](C)/C=C/[C@H](C)C(C)C)C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Chun-Nan, Lin; Shih-Hsieh, Kuo; Shen-Jeu, Won Steroids of formosan Ganoderma amboinense Phytochemistry 1993 32 (6) 1549-1551. | ||
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DOI | 10.1016/0031-9422(93)85177-s | PMID | - |