Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA011293
PROPERTIES
NPAID | NPA011293 |
---|---|
CLUSTER ID | 1070 |
NODE ID | 163 |
NAME | Inonotusol D |
FORMULA | C30H48O5 |
MOLECULAR WEIGHT (Da) | 488.7090 |
ACCURATE MASS (Da) | 488.3502 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Inonotus |
ORIGIN SPECIES | obliquus |
InChIKey | BUJWEABYUGXDHV-BRGCKXBGSA-N |
InChI | InChI=1S/C30H48O5/c1-26(2,35)21-8-7-17(25(21)34)18-11-13-29(5)19-9-10-22-27(3,16-31)23(32)15-24(33)30(22,6)20(19)12-14-28(18,29)4/h9,12,17-18,21-25,31-35H,7-8,10-11,13-16H2,1-6H3/t17-,18+,21-,22+,23+,24+,25+,27+,28-,29+,30-/m1/s1 |
SMILES | C[C@@]12CC[C@H]([C@]1(CC=C3C2=CC[C@@H]4[C@@]3([C@H](C[C@@H]([C@@]4(C)CO)O)O)C)C)[C@H]5CC[C@H]([C@H]5O)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. | ||
---|---|---|---|
DOI | 10.1021/np400552w | PMID | 24359303 |