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Compounds

COMPOUND NPA016158

STRUCTURE

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PROPERTIES

NPAID	NPA016158
CLUSTER ID	164
NODE ID	155
NAME	Actinomycin Z4
FORMULA	C62H84N12O17
MOLECULAR WEIGHT (Da)	1269.4210
ACCURATE MASS (Da)	1268.6077
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	fradiae
InChIKey	UEEVFDRZQAFDKU-HPVLVMQISA-N
InChI	InChI=1S/C62H84N12O17/c1-25(2)43-59(85)73-29(8)19-21-36(73)57(83)69(14)24-40(77)72(17)49(27(5)6)62(88)90-34(13)45(55(81)65-43)67-53(79)35-20-18-28(7)51-47(35)64-48-41(42(63)50(78)30(9)52(48)91-51)54(80)68-46-33(12)89-61(87)32(11)71(16)39(76)23-70(15)58(84)37-22-38(75)31(10)74(37)60(86)44(26(3)4)66-56(46)82/h18,20,25-27,29,31-34,36-37,43-46,49H,19,21-24,63H2,1-17H3,(H,65,81)(H,66,82)(H,67,79)(H,68,80)/t29?,31?,32-,33?,34?,36-,37-,43+,44+,45-,46-,49-/m0/s1
SMILES	C[C@H]1C(=O)OC([C@@H](C(=O)N[C@@H](C(=O)N2[C@@H](CC(=O)C2C)C(=O)N(CC(=O)N1C)C)C(C)C)NC(=O)C3=C(C(=O)C(=C4C3=NC5=C(C=CC(=C5O4)C)C(=O)N[C@H]6C(OC(=O)[C@@H](N(C(=O)CN(C(=O)[C@@H]7CCC(N7C(=O)[C@H](NC6=O)C(C)C)C)C)C)C(C)C)C)C)N)C

ORIGINAL ISOLATION REFERENCE

CITATION	Lackner, H; Bahner, I; Shigematsu, N; Pannell, L K; Mauger, A B Structures of five components of the actinomycin Z complex from Streptomyces fradiae, two of which contain 4-chlorothreonine Journal of Natural Products 2000 63 (3) 352-356.
DOI	10.1021/np990416u	PMID	10757717

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Actinobacteria	LPSN	201174
Class	Actinobacteria	LPSN	-
Order	Streptomycetales	LPSN	85011
Family	Streptomycetaceae	LPSN	2062
Genus	Streptomyces	LPSN	1883

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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