Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA032780
PROPERTIES
| NPAID | NPA032780 |
|---|---|
| CLUSTER ID | 2955 |
| NODE ID | 1508 |
| NAME | Naematolin |
| FORMULA | C17H24O5 |
| MOLECULAR WEIGHT (Da) | 308.3740 |
| ACCURATE MASS (Da) | 308.1624 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Naematoloma |
| ORIGIN SPECIES | fasciculare |
| InChIKey | GCJYDDQHDPNDBI-CNKLGXOISA-N |
| InChI | InChI=1S/C17H24O5/c1-8-6-12(22-10(3)18)15(20)9(2)11-7-17(4,5)13(11)16(21)14(8)19/h6,11-14,16,19,21H,2,7H2,1,3-5H3/b8-6-/t11-,12-,13-,14-,16+/m1/s1 |
| SMILES | C=C1C(=O)[C@H](OC(C)=O)/C=C(/C)[C@@H](O)[C@@H](O)[C@H]2[C@@H]1CC2(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Doi, Kozo; Shibata, Takao; Nara, Masataka; Tsuboyama, Sei; Sakurai, Tosio; Tsuboyama, Kaoru STRUCTURES OF NAEMATOLIN AND NAEMATOLIN B, 1S,9S-RING-FUSED CARYOPHYLLANE SESQUITERPENOIDS Chemistry Letters 1986 15 (5) 653-656. | ||
|---|---|---|---|
| DOI | 10.1246/cl.1986.653 | PMID | - |
