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Compounds

COMPOUND NPA003767

STRUCTURE

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PROPERTIES

NPAID	NPA003767
CLUSTER ID	1239
NODE ID	1050
NAME	Maytansinol-9-methyl ether-3-3'-methylbutyrate
FORMULA	C34H47ClN2O9
MOLECULAR WEIGHT (Da)	663.2080
ACCURATE MASS (Da)	662.2970
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Actinosynnema
ORIGIN SPECIES	pretiosum FIM06-0063
InChIKey	KUOYOPPRMATLNZ-AFGUKAAWSA-N
InChI	InChI=1S/C34H47ClN2O9/c1-19(2)13-29(39)45-27-17-28(38)37(6)23-15-22(16-24(41-7)30(23)35)14-20(3)11-10-12-26(42-8)34(43-9)18-25(44-32(40)36-34)21(4)31-33(27,5)46-31/h10-12,15-16,19,21,25-27,31H,13-14,17-18H2,1-9H3,(H,36,40)/b12-10+,20-11+/t21-,25+,26-,27+,31+,33+,34+/m1/s1
SMILES	C[C@@H]1[C@@H]2C[C@]([C@@H](/C=C/C=C(/CC3=CC(=C(C(=C3)OC)Cl)N(C(=O)C[C@@H]([C@]4([C@H]1O4)C)OC(=O)CC(C)C)C)\C)OC)(NC(=O)O2)OC

ORIGINAL ISOLATION REFERENCE

CITATION	Siyu-Mao; Hong-Chen; Li-Chen; Chuanxi-Wang; Wei-Jia; Xiaoming-Chen; Huangjian-Yang; Wei-Huang; Wei-Zheng Two novel ansamitocin analogs from Actinosynnema pretiosum Natural Product Research 2013 27 (17) 1532-1536.
DOI	10.1080/14786419.2012.733388	PMID	23061718

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Actinobacteria	LPSN	201174
Class	Actinobacteria	LPSN	-
Order	Pseudonocardiales	LPSN	85010
Family	Pseudonocardiaceae	LPSN	2070
Genus	Actinosynnema	LPSN	40566

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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