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Compounds

COMPOUND NPA003640

STRUCTURE

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PROPERTIES

NPAID	NPA003640
CLUSTER ID	17
NODE ID	17
NAME	Paspaline B
FORMULA	C28H37NO3
MOLECULAR WEIGHT (Da)	435.6080
ACCURATE MASS (Da)	435.2773
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Penicillium
ORIGIN SPECIES	paxilli
InChIKey	AYNSNFZADBZRGD-FLWVEUMXSA-N
InChI	InChI=1S/C28H37NO3/c1-25(2,31)22-12-14-28(16-30)21-10-9-17-15-19-18-7-5-6-8-20(18)29-24(19)27(17,4)26(21,3)13-11-23(28)32-22/h5-8,16-17,21-23,29,31H,9-15H2,1-4H3/t17?,21-,22+,23?,26+,27-,28-/m1/s1
SMILES	CC(C)(O)[C@@H]1CC[C@]2(C=O)C(CC[C@@]3(C)[C@H]2CCC2CC4=C(NC5=CC=CC=C45)[C@@]23C)O1

ORIGINAL ISOLATION REFERENCE

CITATION	Munday-Finch, Sarah C.; Wilkins, Alistair L.; Miles, Christopher O. Isolation of paspaline B, an indole-diterpenoid from Penicilium paxilli Phytochemistry 1996 41 (1) 327-332.
DOI	10.1016/0031-9422(95)00515-3	PMID	-

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Eurotiomycetes	MycoBank	147545
Order	Eurotiales	MycoBank	5042
Family	Aspergillaceae	MycoBank	1131492
Genus	Penicillium	MycoBank	5073

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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