Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA017885
PROPERTIES
NPAID | NPA017885 |
---|---|
CLUSTER ID | 5947 |
NODE ID | 4172 |
NAME | Antrodioxolanone |
FORMULA | C29H32O9 |
MOLECULAR WEIGHT (Da) | 524.5660 |
ACCURATE MASS (Da) | 524.2046 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Antrodia |
ORIGIN SPECIES | camphorata |
InChIKey | NJECTZSLZHQUFD-ISILISOKSA-N |
InChI | InChI=1S/C29H32O9/c1-17-19(21(31-5)15-23(33-7)25(17)35-9)11-13-28(3)29(4,38-27(30)37-28)14-12-20-18(2)26(36-10)24(34-8)16-22(20)32-6/h15-16H,1-10H3/t28-,29+ |
SMILES | CC1=C(C(=CC(=C1OC)OC)OC)C#C[C@@]2([C@](OC(=O)O2)(C)C#CC3=C(C(=C(C=C3OC)OC)OC)C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Chen, Jih-Jung; Lin, Wen-Jiou; Liao, Chang-Hui; Shieh, Po-Chuen Anti-inflammatory benzenoids from Antrodia camphorata Journal of Natural Products 2007 70 (6) 989-992. | ||
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DOI | 10.1021/np070045e | PMID | 17559265 |