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Compounds

COMPOUND NPA032535

STRUCTURE

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PROPERTIES

NPAID	NPA032535
CLUSTER ID	6745
NODE ID	4673
NAME	Dumulmycin
FORMULA	C33H48O8
MOLECULAR WEIGHT (Da)	572.7390
ACCURATE MASS (Da)	572.3349
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	sp. DM28
InChIKey	ZXSSCBKIZOGDCJ-GECBTDGCSA-N
InChI	InChI=1S/C33H48O8/c1-7-8-24(34)12-10-21(4)33-23(6)29(37)18-25(35)13-15-27-26(22(5)31(39)32(27)40)14-9-19(2)17-28(36)20(3)11-16-30(38)41-33/h9,11,13-15,17,21,23,25-29,33,35-37,39H,7-8,10,12,16,18H2,1-6H3/b14-9+,15-13-,19-17+,20-11+/t21-,23+,25-,26-,27+,28+,29-,33+/m0/s1
SMILES	CCCC(=O)CC[C@H](C)[C@H]1OC(=O)C/C=C(\C)[C@H](O)/C=C(C)/C=C/[C@H]2C(C)=C(O)C(=O)[C@@H]2/C=C\[C@H](O)C[C@H](O)[C@H]1C

ORIGINAL ISOLATION REFERENCE

CITATION	An, Joon Soo; Shin, Bora; Kim, Tae Ho; Hwang, Sunghoon; Shin, Yern-Hyerk; Cui, Jinsheng; Du, Young Eun; Yi, Jungwoo; Nam, Sang-Jip; Hong, Suckchang; Shin, Jongheon; Jang, Jichan; Yoon, Yeo Joon; Oh, Dong-Chan Dumulmycin, an Antitubercular Bicyclic Macrolide from a Riverine Sediment-Derived Streptomyces sp. Organic Letters 2021 23 (9) 3359-3363.
DOI	10.1021/acs.orglett.1c00847	PMID	33885319

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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