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Compounds

COMPOUND NPA021807

STRUCTURE

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PROPERTIES

NPAID	NPA021807
CLUSTER ID	1025
NODE ID	883
NAME	Quinomycin H2
FORMULA	C52H65N11O13S2
MOLECULAR WEIGHT (Da)	1116.2900
ACCURATE MASS (Da)	1115.4205
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	sp. RAL404
InChIKey	ZEPHHYQCQZIXDY-IGYHIOTESA-N
InChI	InChI=1S/C52H65N11O13S2/c1-25(2)39-50(73)75-22-34(58-42(65)33-21-53-31-18-14-15-19-32(31)56-33)43(66)55-28(6)47(70)63(10)41-49(72)62(9)40(26(3)4)51(74)76-23-35(59-45(68)38-37(64)20-29-16-12-13-17-30(29)57-38)44(67)54-27(5)46(69)60(7)36(48(71)61(39)8)24-78-52(41)77-11/h12-21,25-28,34-36,39-41,52,64H,22-24H2,1-11H3,(H,54,67)(H,55,66)(H,58,65)(H,59,68)/t27-,28-,34+,35+,36-,39-,40-,41+,52?/m0/s1
SMILES	C[C@H]1C(=O)N([C@H]2CSC([C@@H](C(=O)N([C@H](C(=O)OC[C@H](C(=O)N1)NC(=O)C3=NC4=CC=CC=C4C=C3O)C(C)C)C)N(C(=O)[C@@H](NC(=O)[C@@H](COC(=O)[C@@H](N(C2=O)C)C(C)C)NC(=O)C5=NC6=CC=CC=C6N=C5)C)C)SC)C

ORIGINAL ISOLATION REFERENCE

CITATION	Hayakawa, Yoichi; Sone, Risako; Aoki, Haruna; Kimata, Shoko Quinomycins H1 and H2, new cytotoxic antibiotics from Streptomyces sp. RAL404 Journal of Antibiotics 2018 71 (10) 898-901.
DOI	10.1038/s41429-018-0083-6	PMID	30018424

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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