Natural Products Atlas | Compounds

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Compounds

ID	Spectrum Quality	Annotated Name
CCMSLIB00000223299	Bronze	Massbank:PR100479&delta-Tocotrienol\|8-Methyltocotrienol\|(R)-delta-Tocotrienol
CCMSLIB00000220643	Bronze	ReSpect:PS125801&delta-Tocotrienol\|8-Methyltocotrienol\|(R)-delta-Tocotrienol
CCMSLIB00000220645	Bronze	ReSpect:PS125802&delta-Tocotrienol\|8-Methyltocotrienol\|(R)-delta-Tocotrienol
CCMSLIB00000220647	Bronze	ReSpect:PS125803&delta-Tocotrienol\|8-Methyltocotrienol\|(R)-delta-Tocotrienol
CCMSLIB00000221729	Bronze	ReSpect:PT112580&delta-Tocotrienol\|8-Methyltocotrienol\|(R)-delta-Tocotrienol\|(2R)-2,8-dimethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienyl]chroman-6-ol
CCMSLIB00005757344	Gold	3
CCMSLIB00005758622	Gold	3
CCMSLIB00005757820	Gold	3
CCMSLIB00005757870	Gold	3
CCMSLIB00000850254	Gold	1
CCMSLIB00012086888	Gold	4
CCMSLIB00012086885	Gold	4
CCMSLIB00012086886	Gold	4
CCMSLIB00012086887	Gold	4
CCMSLIB00009926685	Gold	4
CCMSLIB00009926682	Gold	4
CCMSLIB00009926683	Gold	4
CCMSLIB00009926684	Gold	4

COMPOUND NPA019103

STRUCTURE

Image structure

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

EXTERNAL LINKS

PROPERTIES

NPAID	NPA019103
CLUSTER ID	4803
NODE ID	3474
NAME	R-δ-tocotrienol
FORMULA	C27H40O2
MOLECULAR WEIGHT (Da)	396.6150
ACCURATE MASS (Da)	396.3028
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Cystophora
ORIGIN SPECIES	monilifera
InChIKey	ODADKLYLWWCHNB-LDYBVBFYSA-N
InChI	InChI=1S/C27H40O2/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-16-27(6)17-15-24-19-25(28)18-23(5)26(24)29-27/h10,12,14,18-19,28H,7-9,11,13,15-17H2,1-6H3/b21-12+,22-14+/t27-/m1/s1
SMILES	CC1=C2C(=CC(=C1)O)CC[C@@](O2)(C)CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C

ORIGINAL ISOLATION REFERENCE

CITATION	Brkljača, Robert; Urban, Sylvia HPLC-NMR and HPLC-MS investigation of antimicrobial constituents in Cystophora monilifera and Cystophora subfarcinata Phytochemistry 2015 117 200-208.
DOI	10.1016/j.phytochem.2015.06.014	PMID	26093325

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Genus	Cystophora	MycoBank	-

CLASSYFIRE

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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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