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Co-precorrin-5B

MNXM47439 is deprecated and here replaced by MNXM736807
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM736807

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	4

formula

C₄₃H₄₂CoN₄O₁₆

charge

-8

mass

929.19716

reference

chebi:60063

InChIKey

XHLLHKIBBMZXKO-NXQAVURYSA-D

InChI

InChI=1S/C43H52N4O16.Co/c1-40(12-11-33(54)55)24(14-35(58)59)38-39-42(3,19-37(62)63)21(6-9-31(50)51)26(45-39)16-29-41(2,18-36(60)61)22(7-10-32(52)53)27(44-29)17-43(4)23(13-34(56)57)20(5-8-30(48)49)25(47-43)15-28(40)46-38;/h15-16,21,24H,5-14,17-19H2,1-4H3,(H10,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63);/q;+2/p-10/b39-38-;/t21-,24+,40-,41+,42+,43+;/m1./s1

SMILES

C[C@]1(CC(=O)[O-])C(CCC(=O)[O-])=C2C[C@@]3(C)C(CC(=O)[O-])=C(CCC(=O)[O-])C4=CC5=[N+]6C(=C7N8C(=CC1=[N+]2[Co-2]86N43)[C@@H](CCC(=O)[O-])[C@]7(C)CC(=O)[O-])[C@H](CC(=O)[O-])[C@@]5(C)CCC(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:60063 chebi:60063	Co-precorrin-5B cobalt-precorrin-5B(8-)
kegg.compound:C16243 keggC:C16243	Cobalt-precorrin 5B
seed.compound:cpd14960 seedM:cpd14960	Cobalt-precorrin 5B cobalt-precorrin-5B
CHEBI:52489 chebi:52489	cobalt-precorrin-5B 3,3',3'',3'''-{[(2S,3S,7S,11S,17R,18R)-2,7,12,18-tetrakis(carboxymethyl)-2,7,11,17-tetramethyl-1,19-didehydrocorrin-3,8,13,17-tetrayl-kappa(4)N(21),N(22),N(23),N(24)]tetrapropanoato(2-)}cobalt Cobalt-precorrin 5B
keggC:M_C16243 seedM:M_cpd14960	secondary/obsolete/fantasy identifier