Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA019644
PROPERTIES
NPAID | NPA019644 |
---|---|
CLUSTER ID | 22 |
NODE ID | 21 |
NAME | Menisporopsin A |
FORMULA | C40H46O17 |
MOLECULAR WEIGHT (Da) | 798.7910 |
ACCURATE MASS (Da) | 798.2735 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Menisporopsis |
ORIGIN SPECIES | theobromae |
InChIKey | MZOGTSLLZCHVTJ-ACLVMWMJSA-N |
InChI | InChI=1S/C40H46O17/c1-18-6-23-11-27(42)15-30(45)35(23)38(50)55-20(3)8-26(41)13-25-14-29(44)17-32(47)37(25)40(52)57-22(5)10-34(49)54-19(2)7-24-12-28(43)16-31(46)36(24)39(51)56-21(4)9-33(48)53-18/h11-12,14-22,26,41-47H,6-10,13H2,1-5H3/t18-,19-,20-,21-,22-,26-/m1/s1 |
SMILES | C[C@@H]1C[C@H](CC2=CC(=CC(=C2C(=O)O[C@@H](CC(=O)O[C@@H](CC3=CC(=CC(=C3C(=O)O[C@@H](CC(=O)O[C@@H](CC4=CC(=CC(=C4C(=O)O1)O)O)C)C)O)O)C)C)O)O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Chinworrungsee, Maneekarn; Kittakoop, Prasat; Isaka, Masahiko; Maithip, Pacharee; Supothina, Sumalee; Thebtaranonth, Yodhathai Isolation and Structure Elucidation of a Novel Antimalarial Macrocyclic Polylactone, Menisporopsin A, from the Fungus Menisporopsis theobromae Journal of Natural Products 2004 67 (4) 689-692. | ||
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DOI | 10.1021/np0304870 | PMID | 15104506 |