Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA012363
PROPERTIES
NPAID | NPA012363 |
---|---|
CLUSTER ID | 2275 |
NODE ID | 1802 |
NAME | Neoergosterol |
FORMULA | C27H40O |
MOLECULAR WEIGHT (Da) | 380.6160 |
ACCURATE MASS (Da) | 380.3079 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Phycomyces |
ORIGIN SPECIES | blakesleeanus |
InChIKey | MNMJPUHGVUDRCV-PBUYBTHQSA-N |
InChI | InChI=1S/C27H40O/c1-17(2)18(3)6-7-19(4)25-12-13-26-24-10-8-20-16-21(28)9-11-22(20)23(24)14-15-27(25,26)5/h6-8,10,17-19,21,25-26,28H,9,11-16H2,1-5H3/b7-6+/t18-,19+,21-,25?,26-,27+/m0/s1 |
SMILES | C[C@H](/C=C/[C@H](C)C(C)C)C1CC[C@@H]2[C@@]1(CCC3=C2C=CC4=C3CC[C@@H](C4)O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Barrero; Enrique Oltra; Poyatos; Jimenez; Oliver Phycomysterols and other sterols from the Fungus phycomyces blakesleeanus Journal of Natural Products 1998 61 (12) 1491-1496. | ||
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DOI | 10.1021/np980199h | PMID | 9868149 |