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Compounds

COMPOUND NPA019608

STRUCTURE

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PROPERTIES

NPAID	NPA019608
CLUSTER ID	216
NODE ID	203
NAME	Diastovaricin II
FORMULA	C44H52N2O12S
MOLECULAR WEIGHT (Da)	832.9690
ACCURATE MASS (Da)	832.3241
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	diastochromogenes subsp. variabilicolor n. subsp.
InChIKey	VEDOKYSBCNXSGP-CGNLVAFYSA-N
InChI	InChI=1S/C44H52N2O12S/c1-22-12-10-8-9-11-13-34(51)46-37-41(55)30-19-27(6)40(54)36(35(30)42(56)43(37)59-21-31(44(57)58)45-28(7)47)39(53)26(5)18-25(4)38(52)24(3)15-17-29(48)16-14-23(2)33(50)20-32(22)49/h8-15,17-19,22,24-25,29,31-32,38,48-49,52,54H,16,20-21H2,1-7H3,(H,45,47)(H,46,51)(H,57,58)/b9-8+,12-10-,13-11-,17-15+,23-14+,26-18+/t22-,24-,25-,29-,31?,32-,38-/m0/s1
SMILES	C[C@H]1/C=C\C=C\C=C/C(=O)NC2=C(C(=O)C3=C(C(=C(C=C3C2=O)C)O)C(=O)/C(=C/[C@@H]([C@H]([C@H](/C=C/[C@H](C/C=C(/C(=O)C[C@@H]1O)\C)O)C)O)C)/C)SCC(C(=O)O)NC(=O)C

ORIGINAL ISOLATION REFERENCE

CITATION	Hotta, M; Hayakawa, Y; Furihata, K; Shimazu, A; Seto, H; Otake, N New ansamycin antibiotics, diastovaricins I and II Journal of Antibiotics 1986 39 (2) 311-313.
DOI	10.7164/antibiotics.39.311	PMID	3457001

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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