Natural Products Atlas

Compounds

ID	Spectrum Quality	Annotated Name
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
CCMSLIB00006500750	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

STRUCTURE

EXPORT OPTIONS	PNG JSON SDF
PROJECT MOLECULE TO GLOBAL VIEW	See Global

EXTERNAL LINKS

PROPERTIES

NPAID	NPA003129
CLUSTER ID	247
NODE ID	227
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

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Basidiomycota	MycoBank	5204
Class	Agaricomycetes	MycoBank	155619
Order	Polyporales	MycoBank	5303
Family	Fomitopsidaceae	MycoBank	1769247
Genus	Antrodia	MycoBank	40415

CLASSYFIRE

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DESCRIPTION	[[ getValue('description') ]]
KINGDOM	[[ getValue('kingdom') ]]
SUPER CLASS	[[ getValue('superclass') ]]
CLASS	[[ getValue('class') ]]
SUB CLASS	[[ getValue('subclass') ]]
MOLECULAR FRAMEWORK	[[ getValue('molecular_framework') ]]

NP CLASSIFIER

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SUPER CLASS	[[ getValue('superclass_results') ]]
CLASS	[[ getValue('class_results') ]]
PATHWAY	[[ getValue('pathway_results') ]]
IS GLYCOSIDE?	[[ getValue('isglycoside') ]]

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Compounds

COMPOUND NPA003129

STRUCTURE

PROPERTIES

ORIGINAL ISOLATION REFERENCE

ORIGINAL ISOLATION TAXONOMY

CLASSYFIRE

NP CLASSIFIER