Compounds
ID | Spectrum Quality | Annotated Name |
---|---|---|
CCMSLIB00006500750 | Gold | 1 |
CCMSLIB00006435687 | Gold | 1 |
CCMSLIB00006435688 | Gold | 1 |
CCMSLIB00006435764 | Gold | 1 |
CCMSLIB00006435765 | Gold | 1 |
CCMSLIB00006435838 | Gold | 1 |
CCMSLIB00006435839 | Gold | 1 |
CCMSLIB00006435915 | Gold | 1 |
CCMSLIB00006435916 | Gold | 1 |
CCMSLIB00006435987 | Gold | 1 |
CCMSLIB00006435988 | Gold | 1 |
CCMSLIB00006499280 | Gold | 1 |
CCMSLIB00006499281 | Gold | 1 |
CCMSLIB00006499308 | Gold | 1 |
CCMSLIB00006499309 | Gold | 1 |
CCMSLIB00006499337 | Gold | 1 |
CCMSLIB00006499365 | Gold | 1 |
CCMSLIB00006499394 | Gold | 1 |
CCMSLIB00006499422 | Gold | 1 |
CCMSLIB00006499423 | Gold | 1 |
CCMSLIB00006499795 | Gold | 1 |
CCMSLIB00006499796 | Gold | 1 |
CCMSLIB00006499821 | Gold | 1 |
CCMSLIB00006499822 | Gold | 1 |
CCMSLIB00006499848 | Gold | 1 |
CCMSLIB00006499849 | Gold | 1 |
CCMSLIB00006499875 | Gold | 1 |
CCMSLIB00006499876 | Gold | 1 |
CCMSLIB00006499902 | Gold | 1 |
CCMSLIB00006499903 | Gold | 1 |
CCMSLIB00006499925 | Gold | 1 |
CCMSLIB00006499926 | Gold | 1 |
CCMSLIB00006500293 | Gold | 1 |
CCMSLIB00006500307 | Gold | 1 |
CCMSLIB00006500308 | Gold | 1 |
CCMSLIB00006500347 | Gold | 1 |
CCMSLIB00006500370 | Gold | 1 |
CCMSLIB00006500767 | Gold | 1 |
CCMSLIB00006500787 | Gold | 1 |
CCMSLIB00006500788 | Gold | 1 |
CCMSLIB00006500804 | Gold | 1 |
CCMSLIB00006500818 | Gold | 1 |
CCMSLIB00006501112 | Gold | 1 |
CCMSLIB00006501113 | Gold | 1 |
CCMSLIB00006501130 | Gold | 1 |
CCMSLIB00006501131 | Gold | 1 |
CCMSLIB00006501153 | Gold | 1 |
CCMSLIB00006501173 | Gold | 1 |
CCMSLIB00006501192 | Gold | 1 |
CCMSLIB00006501193 | Gold | 1 |
CCMSLIB00006501212 | Gold | 1 |
CCMSLIB00006501213 | Gold | 1 |
CCMSLIB00004688275 | Bronze | 4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one |
CCMSLIB00004708590 | Bronze | 4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one |
CCMSLIB00004708591 | Bronze | 4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one |
CCMSLIB00004708592 | Bronze | 4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one |
CCMSLIB00004708593 | Bronze | 4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one |
CCMSLIB00004708594 | Bronze | 4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one |
CCMSLIB00004708595 | Bronze | 4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one |
CCMSLIB00004708596 | Bronze | 4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one |
CCMSLIB00004708597 | Bronze | 4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one |
CCMSLIB00004708598 | Bronze | 4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one |
CCMSLIB00004708599 | Bronze | 4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one |
CCMSLIB00004708600 | Bronze | 4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one |
CCMSLIB00004708601 | Bronze | 4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one |
CCMSLIB00004708602 | Bronze | 4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one |
CCMSLIB00004708603 | Bronze | 4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one |
CCMSLIB00004708604 | Bronze | 4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one |
CCMSLIB00004688274 | Bronze | 4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one |
CCMSLIB00000851499 | Gold | 1!CCMSLIB00000851501 |
CCMSLIB00012092284 | Gold | 4 |
CCMSLIB00012092283 | Gold | 4 |
CCMSLIB00009932081 | Gold | 4 |
CCMSLIB00009932080 | Gold | 4 |
COMPOUND NPA003129
PROPERTIES
NPAID | NPA003129 |
---|---|
CLUSTER ID | 246 |
NODE ID | 226 |
NAME | 14-Deoxy-11,12-didehydroandrographolide |
FORMULA | C20H28O4 |
MOLECULAR WEIGHT (Da) | 332.4400 |
ACCURATE MASS (Da) | 332.1988 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Antrodia |
ORIGIN SPECIES | camphorata |
InChIKey | XMJAJFVLHDIEHF-YFFHYEMFSA-N |
InChI | InChI=1S/C20H28O4/c1-13-4-7-16-19(2,10-8-17(22)20(16,3)12-21)15(13)6-5-14-9-11-24-18(14)23/h5-6,9,15-17,21-22H,1,4,7-8,10-12H2,2-3H3/b6-5+/t15-,16+,17-,19+,20+/m0/s1 |
SMILES | C[C@]12CC[C@@H]([C@]([C@@H]1CCC(=C)[C@@H]2/C=C/C3=CCOC3=O)(C)CO)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Chen, Cheng-Chi; Shiao, Young-Ji; Lin, Ruei-Da; Shao, Yi-Yuan; Lai, Min-Nan; Lin, Chun-Ching; Ng, Lean-Teik; Kuo, Yueh-Hsiung Neuroprotective Diterpenes from the Fruiting Body of Antrodia camphorata Journal of Natural Products 2006 69 (4) 689-691. | ||
---|---|---|---|
DOI | 10.1021/np0581263 | PMID | 16643055 |