Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA016403
PROPERTIES
NPAID | NPA016403 |
---|---|
CLUSTER ID | 1942 |
NODE ID | 1561 |
NAME | Leucopaxillone B |
FORMULA | C34H52O8 |
MOLECULAR WEIGHT (Da) | 588.7820 |
ACCURATE MASS (Da) | 588.3662 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Leucopaxillus |
ORIGIN SPECIES | gentianeus |
InChIKey | DSTOROHYHNDBMG-ZWRBYNDMSA-N |
InChI | InChI=1S/C34H52O8/c1-19(25(41-20(2)35)16-28(30(6,7)38)42-21(3)36)22-14-15-31(8)26-12-10-23-24(11-13-27(37)29(23,4)5)32(26,9)34(39)17-33(22,31)18-40-34/h10,19,22,24-26,28,38-39H,11-18H2,1-9H3/t19-,22?,24+,25+,26-,28+,31-,32-,33-,34-/m0/s1 |
SMILES | C[C@@H](C1CC[C@@]2([C@]13C[C@@]([C@@]4([C@H]2CC=C5[C@H]4CCC(=O)C5(C)C)C)(OC3)O)C)[C@@H](C[C@H](C(C)(C)O)OC(=O)C)OC(=O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Clericuzio, Marco; Mella, Mariella; Vita-Finzi, Paola; Zema, Michele; Vidari, Giovanni Cucurbitane triterpenoids from Leucopaxillus gentianeus Journal of Natural Products 2004 67 (11) 1823-1828. | ||
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DOI | 10.1021/np049883o | PMID | 15568769 |