Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA004043
PROPERTIES
NPAID | NPA004043 |
---|---|
CLUSTER ID | 2151 |
NODE ID | 28 |
NAME | (-)-(1R,4R,5S,6R,7S, 10R)-cadinan-1,4,5-triol |
FORMULA | C15H28O3 |
MOLECULAR WEIGHT (Da) | 256.3860 |
ACCURATE MASS (Da) | 256.2038 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Unknown-fungus |
ORIGIN SPECIES | sp. |
InChIKey | NYZINEQQHFXDCC-ARSDKDGVSA-N |
InChI | InChI=1S/C15H28O3/c1-9(2)11-6-5-10(3)15(18)8-7-14(4,17)13(16)12(11)15/h9-13,16-18H,5-8H2,1-4H3/t10-,11+,12-,13+,14-,15-/m1/s1 |
SMILES | C[C@@H]1CC[C@H]([C@H]2[C@]1(CC[C@@]([C@H]2O)(C)O)O)C(C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Song, Fuhang; Fan, Xiao; Xu, Xiuli; Zhao, Jielu; Yang, Yongchun; Shi, Jiangong Cadinane sesquiterpenes from the brown alga Dictyopteris divaricata Journal of Natural Products 2004 67 (10) 1644-1649. | ||
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DOI | 10.1021/np040099d | PMID | 15497933 |