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Compounds

COMPOUND NPA005771

STRUCTURE

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PROPERTIES

NPAID	NPA005771
CLUSTER ID	2790
NODE ID	2154
NAME	Bacteriochlorophyll b
FORMULA	C55H74N4O6
MOLECULAR WEIGHT (Da)	887.2190
ACCURATE MASS (Da)	886.5608
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Rhodopseudomonas
ORIGIN SPECIES	viridis
InChIKey	SFKCKJXMIAKQMY-QJERPKBESA-N
InChI	InChI=1S/C55H74N4O6/c1-13-39-34(7)41-29-46-48(38(11)60)36(9)43(57-46)27-42-35(8)40(52(58-42)50-51(55(63)64-12)54(62)49-37(10)44(59-53(49)50)28-45(39)56-41)23-24-47(61)65-26-25-33(6)22-16-21-32(5)20-15-19-31(4)18-14-17-30(2)3/h13,25,27-32,34-35,40,51,57,59H,14-24,26H2,1-12H3/b33-25+,39-13-,41-29?,42-27?,43-27?,44-28?,45-28?,46-29?,52-50?/t31-,32-,34-,35+,40+,51-/m1/s1
SMILES	C/C=C\1/[C@H](C2=CC3=C(C(=C(N3)C=C4[C@H]([C@@H](C(=N4)C5=C6C(=C(C(=CC1=N2)N6)C)C(=O)[C@@H]5C(=O)OC)CCC(=O)OC/C=C(\C)/CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C)C)C(=O)C)C

ORIGINAL ISOLATION REFERENCE

CITATION	Scheer, Hugo; Svec, Walter A; Cope, Ben T; Studier, Martin H; Scott, Robert G; Katz, Joseph J Structure of bacteriochlorophyll b Journal of the American Chemical Society 1974 96 (11) 3714-3716.
DOI	10.1021/ja00818a092	PMID	-

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Proteobacteria	LPSN	1224
Class	Alphaproteobacteria	LPSN	28211
Order	Rhizobiales	LPSN	-
Family	Bradyrhizobiaceae	LPSN	41294
Genus	Rhodopseudomonas	LPSN	1073

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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