Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA005924
PROPERTIES
NPAID | NPA005924 |
---|---|
CLUSTER ID | 69 |
NODE ID | 64 |
NAME | methyl aeruginosate A |
FORMULA | C39H62O11 |
MOLECULAR WEIGHT (Da) | 706.9140 |
ACCURATE MASS (Da) | 706.4292 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Stropharia |
ORIGIN SPECIES | aeruginosa |
InChIKey | OQSCGTICQTZHSH-KCLRKXCRSA-N |
InChI | InChI=1S/C39H62O11/c1-21(40)48-32-26(49-31(43)20-36(6,46)19-30(42)47-10)18-37(7)25-17-28(41)39(9)23(22-11-14-29(35(4,5)45)50-33(22)44)15-16-38(39,8)24(25)12-13-27(37)34(32,2)3/h17,22-24,26-29,32-33,41,44-46H,11-16,18-20H2,1-10H3/t22-,23-,24?,26-,27?,28+,29-,32+,33?,36?,37-,38+,39+/m1/s1 |
SMILES | CC(=O)O[C@H]1[C@@H](C[C@]2(C(C1(C)C)CCC3C2=C[C@@H]([C@]4([C@]3(CC[C@@H]4[C@H]5CC[C@@H](OC5O)C(C)(C)O)C)C)O)C)OC(=O)CC(C)(CC(=O)OC)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Shiono, Yoshihito; Sugasawa, Hiromi; Kurihara, Naomi; Nazarova, Margarita; Murayama, Tetsuya; Takahashi, Koetsu; Ikeda, Michimasa Three lanostane triterpenoids from the fruiting bodies ofStropharia aeruginosa Journal of Asian Natural Products Research 2005 7 (5) 735-740. | ||
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DOI | 10.1080/1028602042000325546 | PMID | 16176906 |