Compounds
ID | Spectrum Quality | Annotated Name |
---|---|---|
CCMSLIB00004751239 | Gold | 3 |
CCMSLIB00009919255 | Gold | 3 |
COMPOUND NPA005583
PROPERTIES
NPAID | NPA005583 |
---|---|
CLUSTER ID | 46 |
NODE ID | 11 |
NAME | Atranoric acid |
FORMULA | C19H18O8 |
MOLECULAR WEIGHT (Da) | 374.3450 |
ACCURATE MASS (Da) | 374.1002 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Unknown-fungus |
ORIGIN SPECIES | sp. |
InChIKey | YLOYKYXNDHOHHT-UHFFFAOYSA-N |
InChI | InChI=1S/C19H18O8/c1-8-5-12(21)11(7-20)17(23)15(8)19(25)27-13-6-9(2)14(18(24)26-4)16(22)10(13)3/h5-7,21-23H,1-4H3 |
SMILES | CC1=CC(=C(C(=C1C(=O)OC2=C(C(=C(C(=C2)C)C(=O)OC)O)C)O)C=O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Honorato, R.; Rojas, C.; Ivanovic, N. Sodium Oxalate as Anticoagulant Experimental Biology and Medicine 1948 68 (2) 300-301. | ||
---|---|---|---|
DOI | 10.3181/00379727-68-16463p | PMID | 18869326 |