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Compounds

COMPOUND NPA008169

STRUCTURE

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PROPERTIES

NPAID	NPA008169
CLUSTER ID	647
NODE ID	574
NAME	Rebeccamycin
FORMULA	C27H21Cl2N3O7
MOLECULAR WEIGHT (Da)	570.3850
ACCURATE MASS (Da)	569.0757
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Nocardia
ORIGIN SPECIES	aerocoligenes
InChIKey	QEHOIJJIZXRMAN-QZQSLCQPSA-N
InChI	InChI=1S/C27H21Cl2N3O7/c1-38-24-13(8-33)39-27(23(35)22(24)34)32-20-10(5-3-7-12(20)29)15-17-16(25(36)31-26(17)37)14-9-4-2-6-11(28)18(9)30-19(14)21(15)32/h2-7,13,22-24,27,30,33-35H,8H2,1H3,(H,31,36,37)/t13-,22-,23-,24-,27-/m1/s1
SMILES	CO[C@@H]1[C@H](O[C@H]([C@@H]([C@H]1O)O)N2C3=C(C=CC=C3Cl)C4=C5C(=C6C7=C(C(=CC=C7)Cl)NC6=C42)C(=O)NC5=O)CO

ORIGINAL ISOLATION REFERENCE

CITATION	Nettleton, D. E.; Doyle, T. W.; Krishnan, B.; Matsumoto, G. K.; Clardy, J. ISOLATION AND STRUCTURE OF REBECCAMYCIN - A NEW ANTITUMOR ANTIBIOTIC FROM NOCARDIA AEROCOLIGENES Tetrahedron Letters 1985 26 (34) 4011-4014.
DOI	10.1016/s0040-4039(00)89280-1	PMID	-

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Actinobacteria	LPSN	201174
Class	Actinobacteria	LPSN	-
Order	Corynebacteriales	LPSN	85007
Family	Nocardiaceae	LPSN	85025
Genus	Nocardia	LPSN	1817

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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