Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA009871
PROPERTIES
NPAID | NPA009871 |
---|---|
CLUSTER ID | 1280 |
NODE ID | 163 |
NAME | 5α,6α-epoxy-(22E)-ergosta-8,14, 22-triene-3β,7α-diol |
FORMULA | C28H42O3 |
MOLECULAR WEIGHT (Da) | 426.6410 |
ACCURATE MASS (Da) | 426.3134 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Lentinula |
ORIGIN SPECIES | edodes |
InChIKey | USHMBEFGKMCIBD-AAXQUGDCSA-N |
InChI | InChI=1S/C28H42O3/c1-16(2)17(3)7-8-18(4)20-9-10-21-23-22(12-13-26(20,21)5)27(6)14-11-19(29)15-28(27)25(31-28)24(23)30/h7-8,10,16-20,24-25,29-30H,9,11-15H2,1-6H3/b8-7+/t17-,18+,19-,20+,24-,25-,26+,27+,28-/m0/s1 |
SMILES | C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CC=C2[C@@]1(CCC3=C2[C@@H]([C@H]4[C@@]5([C@@]3(CC[C@@H](C5)O)C)O4)O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | OHNUMA, Naoko; AMEMIYA, Keiko; KAKUDA, Rie; YAOITA, Yasunori; MACHIDA, Koichi; KIKUCHI, Masao Sterol Constituents from Two Edible Mushrooms, Lentinula edodes and Tricholoma matsutake Chemical and Pharmaceutical Bulletin 2000 48 (5) 749-751. | ||
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DOI | 10.1248/cpb.48.749 | PMID | 10823718 |