Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA003749
PROPERTIES
NPAID | NPA003749 |
---|---|
CLUSTER ID | 69 |
NODE ID | 64 |
NAME | Inonotusol G |
FORMULA | C30H48O3 |
MOLECULAR WEIGHT (Da) | 456.7110 |
ACCURATE MASS (Da) | 456.3603 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Inonotus |
ORIGIN SPECIES | obliquus |
InChIKey | NRZPHWXZFDFOQN-UEYCSXIMSA-N |
InChI | InChI=1S/C30H48O3/c1-18(2)23(31)17-24(32)19(3)20-11-15-30(8)22-9-10-25-27(4,5)26(33)13-14-28(25,6)21(22)12-16-29(20,30)7/h19-20,24-26,32-33H,1,9-17H2,2-8H3/t19?,20-,24?,25+,26+,28-,29-,30+/m1/s1 |
SMILES | CC([C@H]1CC[C@@]2([C@@]1(CCC3=C2CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O)C)C)C)C(CC(=O)C(=C)C)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Liu, Chao; Zhao, Cui; Pan, Hong-Hui; Kang, Jie; Yu, Xiong-Tao; Wang, Hong-Qing; Li, Bao-Ming; Xie, Yi-Zhen; Chen, Ruo-Yun Chemical constituents from Inonotus obliquus and their biological activities Journal of Natural Products 2014 77 (1) 35-41. | ||
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DOI | 10.1021/np400552w | PMID | 24359303 |