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Compounds

ID	Spectrum Quality	Annotated Name
CCMSLIB00004709397	Bronze	(5R,6S,8Z,11S)-5,6,15-trihydroxy-17-methoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),8,15,17-tetraene-7,13-dione
CCMSLIB00004709398	Bronze	(5R,6S,8Z,11S)-5,6,15-trihydroxy-17-methoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),8,15,17-tetraene-7,13-dione
CCMSLIB00004709399	Bronze	(5R,6S,8Z,11S)-5,6,15-trihydroxy-17-methoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),8,15,17-tetraene-7,13-dione
CCMSLIB00004709400	Bronze	(5R,6S,8Z,11S)-5,6,15-trihydroxy-17-methoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),8,15,17-tetraene-7,13-dione
CCMSLIB00004709401	Bronze	(5R,6S,8Z,11S)-5,6,15-trihydroxy-17-methoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),8,15,17-tetraene-7,13-dione
CCMSLIB00004709402	Bronze	(5R,6S,8Z,11S)-5,6,15-trihydroxy-17-methoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),8,15,17-tetraene-7,13-dione
CCMSLIB00004709403	Bronze	(5R,6S,8Z,11S)-5,6,15-trihydroxy-17-methoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),8,15,17-tetraene-7,13-dione
CCMSLIB00004709404	Bronze	(5R,6S,8Z,11S)-5,6,15-trihydroxy-17-methoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),8,15,17-tetraene-7,13-dione
CCMSLIB00004709405	Bronze	(5R,6S,8Z,11S)-5,6,15-trihydroxy-17-methoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),8,15,17-tetraene-7,13-dione
CCMSLIB00004709406	Bronze	(5R,6S,8Z,11S)-5,6,15-trihydroxy-17-methoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),8,15,17-tetraene-7,13-dione
CCMSLIB00004709407	Bronze	(5R,6S,8Z,11S)-5,6,15-trihydroxy-17-methoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),8,15,17-tetraene-7,13-dione
CCMSLIB00004709408	Bronze	(5R,6S,8Z,11S)-5,6,15-trihydroxy-17-methoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),8,15,17-tetraene-7,13-dione
CCMSLIB00004709409	Bronze	(5R,6S,8Z,11S)-5,6,15-trihydroxy-17-methoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),8,15,17-tetraene-7,13-dione
CCMSLIB00004709410	Bronze	(5R,6S,8Z,11S)-5,6,15-trihydroxy-17-methoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),8,15,17-tetraene-7,13-dione
CCMSLIB00004709411	Bronze	(5R,6S,8Z,11S)-5,6,15-trihydroxy-17-methoxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),8,15,17-tetraene-7,13-dione
CCMSLIB00000851787	Gold	1!CCMSLIB00000851789

COMPOUND NPA012221

STRUCTURE

Image structure

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

EXTERNAL LINKS

PROPERTIES

NPAID	NPA012221
CLUSTER ID	22
NODE ID	21
NAME	L-783277
FORMULA	C19H24O7
MOLECULAR WEIGHT (Da)	364.3940
ACCURATE MASS (Da)	364.1522
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Phoma
ORIGIN SPECIES	sp.
InChIKey	QXPNJMHRUZCEAP-MKICMPBKSA-N
InChI	InChI=1S/C19H24O7/c1-11-5-3-7-14(20)18(23)15(21)8-4-6-12-9-13(25-2)10-16(22)17(12)19(24)26-11/h3,7,9-11,15,18,21-23H,4-6,8H2,1-2H3/b7-3-/t11?,15-,18+/m0/s1
SMILES	CC1C/C=C\C(=O)[C@H]([C@H](CCCC2=CC(=CC(=C2C(=O)O1)O)OC)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	ZHAO, ANNIE; LEE, SEOK H.; MOIENA, MARINA; JENKINS, ROSALIND G.; PATRICK, DENIS R.; HUBER, HANS E.; GOETZ, MICHAEL A.; HENSENS, OTTO D.; ZINK, DEBORAH L.; VILELLA, DOLORES; DOMBROWSKI, ANNE W.; LINGHAM, RUSSELL B.; HUANG, LEEYUAN Resorcylic Acid Lactones. Naturally Occurring Potent and Sclective Inbibitors Journal of Antibiotics 1999 52 (12) 1086-1094.
DOI	10.7164/antibiotics.52.1086	PMID	10695671

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Dothideomycetes	MycoBank	147541
Order	Pleosporales	MycoBank	92860
Genus	Phoma	MycoBank	37463

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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