BMCCPPCB0005

Basic Metabolism Top (代謝トップ)

Molecule Index (化合物索引)

EC classes ( EC分類)

Input New Data (新規入力)

Upper classes : BM Basic Metabolites : BMCC Conjugated cycle 共役環 : BMCCPP porphyrin ring ポルフィリン環 :  BMCCPPCB cobalamin コバラミン (13 pages)

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	?
KEGG	C06506
KNApSAcK	{{{KNApSAcK}}}
CDX file
MOL file	BMCCPPCB0005.mol

Adenosyl cobyrinate a,c diamide
Structural Information
Systematic Name	(2R,3R,4S,5R) -2- (6-Aminopurin-9-yl) -5-methanidyloxolane-3,4-diol; 3- [(1R,2S,3S,4Z,7S,8S,9Z,13S,14Z,17R,18R) -2,7-bis(2-amino-2-oxoethyl) -8,13,17-tris(2-carboxyethyl) -18- (carboxymethyl) -1,2,5,7,12,12,15,17-octamethyl-8,13,18,19-tetrahydro-3H-corrin-21-id-3-yl] propanoic acid; cobalt(3+)
Common Name	Adenosyl cobyrinate a,c diamide Adenosyl cobyrinate diamide Adenosylcob (III) yrinic acid a,c-diamide Adenosylcobyrinic acid a,c-diamide
Symbol
Formula	C55H73CoN11O15
Exact Mass	1186.4619
Average Mass	1187.1664
SMILES	O[C@H]([C@H](O)1)[C@H](n(c%11%10)cnc%10c(ncn%11)N)O[C@@H]1C[Co+2](N7=8)(N5=6)(N34)N(C2=9)=C(C(=C3[C@@]([C@@H](CC(O)=O)C([C@]5(C)[C@]([C@@H](C(C(=C7[C@@](CC(N)=O)(C)[C@H](CCC(O)=O)C(C9)8)C)6)CCC(O)=O)(C)CC(N)=O)4)(C)CCC(O)=O)C)[C@H](C2(C)C)CCC(=O)O
Physicochemical Information
Melting Point
Boiling Point
Density
Optical Rotation
Reflactive Index
Solubility
Spectral Information
Mass Spectra
UV Spectra
IR Spectra
NMR Spectra
Chromatograms

Related Atomic Mappings, Enzymes, and Pathways

• this ⇔ (2R,3R,4S,5R) -2- (6-Aminopurin-9-yl) -5-methanidyloxolane-3,4-diol; cobalt(3+) ; 3- [(2R,3R,5Z,7S,10Z,12S,13S,15Z,17S,18S,19R) -2,13,18-tris(2-amino-2-oxoethyl) -7,12,17-tris(3-amino-3-oxopropyl) -3,5,8,8,13,15,18,19-octamethyl-2,7,12,17-tetrahydro-1H-corrin-24-id-3-yl] propanoic acid
• 3- [(1R,2S,3S,4Z,7S,8S,9Z,13S,14Z,17R,18R) -2,7-Bis (2-amino-2-oxoethyl) -8,13,17-tris(2-carboxyethyl) -18- (carboxymethyl) -1,2,5,7,12,12,15,17-octamethyl-8,13,18,19-tetrahydro-3H-corrin-21-id-3-yl] propanoic acid; cobalt ⇔ this
• ATP ⇔ this