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Compounds

COMPOUND NPA009297

STRUCTURE

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PROPERTIES

NPAID	NPA009297
CLUSTER ID	1662
NODE ID	1358
NAME	Chromomycin SA2
FORMULA	C56H80O25
MOLECULAR WEIGHT (Da)	1153.2310
ACCURATE MASS (Da)	1152.4989
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	sp. SNB-005
InChIKey	APJCERXOJXYNFX-FKAWAMMXSA-N
InChI	InChI=1S/C56H80O25/c1-21(2)55(66)81-53-27(8)74-41(20-56(53,10)67)78-35-17-38(70-23(4)46(35)61)77-34-18-40(71-24(5)45(34)60)80-51-31(52(69-12)54(64)65)14-29-13-30-15-33(22(3)44(59)42(30)47(62)43(29)48(51)63)76-39-19-36(50(26(7)73-39)75-28(9)57)79-37-16-32(58)49(68-11)25(6)72-37/h13,15,21,23-27,31-32,34-41,45-46,49-53,58-62,67H,14,16-20H2,1-12H3,(H,64,65)/t23-,24-,25-,26-,27+,31-,32-,34-,35-,36-,37-,38+,39+,40+,41+,45-,46-,49+,50+,51+,52+,53+,56+/m1/s1
SMILES	C[C@@H]1[C@H]([C@@H](C[C@@H](O1)O[C@H]2[C@@H](CC3=C(C2=O)C(=C4C(=C3)C=C(C(=C4O)C)O[C@H]5C[C@H]([C@H]([C@H](O5)C)OC(=O)C)O[C@@H]6C[C@H]([C@H]([C@H](O6)C)OC)O)O)[C@@H](C(=O)O)OC)O[C@H]7C[C@H]([C@@H]([C@H](O7)C)O)O[C@H]8C[C@]([C@H]([C@@H](O8)C)OC(=O)C(C)C)(C)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Hu, Youcai; Espindola, Ana Paula D M; Stewart, Nathan A; Wei, Shuguang; Posner, Bruce A; MacMillan, John B Chromomycin SA analogs from a marine-derived Streptomyces sp Bioorganic and Medicinal Chemistry 2011 19 (17) 5183-5189.
DOI	10.1016/j.bmc.2011.07.013	PMID	21807523

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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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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