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Compounds

COMPOUND NPA021028

STRUCTURE

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PROPERTIES

NPAID	NPA021028
CLUSTER ID	46
NODE ID	11
NAME	2-hydroxyaclacinomycin A
FORMULA	C42H53NO16
MOLECULAR WEIGHT (Da)	827.8770
ACCURATE MASS (Da)	827.3364
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	galilaeus KE303
InChIKey	OPLSIDPSRWNQIH-RTHNWMTRSA-N
InChI	InChI=1S/C42H53NO16/c1-8-42(52)16-28(33-21(35(42)41(51)53-7)13-23-34(38(33)50)37(49)32-22(36(23)48)11-20(44)12-26(32)46)57-30-14-24(43(5)6)39(18(3)55-30)59-31-15-27(47)40(19(4)56-31)58-29-10-9-25(45)17(2)54-29/h11-13,17-19,24,27-31,35,39-40,44,46-47,50,52H,8-10,14-16H2,1-7H3/t17-,18+,19+,24-,27+,28+,29-,30+,31-,35+,39+,40+,42-/m0/s1
SMILES	CC[C@@]1(C[C@H](C2=C([C@@H]1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C=C(C=C4C3=O)O)O)O[C@@H]5C[C@@H]([C@@H]([C@H](O5)C)O[C@H]6C[C@H]([C@@H]([C@H](O6)C)O[C@H]7CCC(=O)[C@@H](O7)C)O)N(C)C)O

ORIGINAL ISOLATION REFERENCE

CITATION	Oki T; Yoshimoto A; Matsuzawa Y; Takeuchi T; Umezawa H NEW ANTHRACYCLINE ANTIBIOTIC, 2-HYDROXYACLACINOMYCIN A Journal of Antibiotics 1981 34 (7) 916-918.
DOI	10.7164/antibiotics.34.916	PMID	6945302

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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