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Compounds

COMPOUND NPA032310

STRUCTURE

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PROPERTIES

NPAID	NPA032310
CLUSTER ID	647
NODE ID	574
NAME	Loonamycin B
FORMULA	C34H34Cl2N4O11
MOLECULAR WEIGHT (Da)	745.5690
ACCURATE MASS (Da)	744.1601
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Nocardiopsis
ORIGIN SPECIES	flavescens NA01583
InChIKey	MESNVWVVXFZXAZ-OVUMEKFMSA-N
InChI	InChI=1S/C34H34Cl2N4O11/c1-39(2)14-10-49-18(8-15(14)42)50-16-7-12-19-21-22(33(47)38-32(21)46)20-11-5-4-6-13(35)26(11)40(27(20)25(19)37-24(12)23(36)28(16)43)34-30(45)29(44)31(48-3)17(9-41)51-34/h4-7,14-15,17-18,29-31,34,37,41-45H,8-10H2,1-3H3,(H,38,46,47)/t14-,15+,17+,18+,29+,30+,31-,34+/m0/s1
SMILES	CO[C@H]1[C@@H](CO)O[C@@H](N2C3=C(C=CC=C3Cl)C3=C4C(=O)NC(=O)C4=C4C5=CC(O[C@@H]6C[C@@H](O)[C@@H](N(C)C)CO6)=C(O)C(Cl)=C5NC4=C32)[C@H](O)[C@H]1O

ORIGINAL ISOLATION REFERENCE

CITATION	Yang, Cheng Long; Zhang, Bo; Xue, Wen Wen; Li, Wu; Xu, Zi Fei; Shi, Jing; Shen, Yan; Jiao, Rui Hua; Tan, Ren Xiang; Ge, Hui Ming Discovery, Biosynthesis, and Heterologous Production of Loonamycin, a Potent Anticancer Indolocarbazole Alkaloid. Organic Letters 2020 22 (12) 4665-4669.
DOI	10.1021/acs.orglett.0c01456	PMID	32484694

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Actinobacteria	LPSN	201174
Class	Actinobacteria	LPSN	-
Order	Streptosporangiales	LPSN	85012
Family	Nocardiopsaceae	LPSN	83676
Genus	Nocardiopsis	LPSN	2013

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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