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precorrin-6A

PropertiesImageOccurences in reactions
MNX_IDMNXM1496Image of MNXM1496
#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 4
formulaC44H47N4O16
charge-7
mass887.86134
referencechebi:77872
InChIKeySOHWQLUTRKYCGZ-YTMGQXKNSA-G
InChIInChI=1S/C44H54N4O16/c1-40(13-12-34(55)56)25(15-36(59)60)39-44(5)42(3,20-38(63)64)23(8-11-33(53)54)27(48-44)17-30-41(2,19-37(61)62)22(7-10-32(51)52)28(45-30)18-43(4)24(14-35(57)58)21(6-9-31(49)50)26(47-43)16-29(40)46-39/h17,23,48H,6-16,18-20H2,1-5H3,(H,49,50)(H,51,52)(H,53,54)(H,55,56)(H,57,58)(H,59,60)(H,61,62)(H,63,64)/p-7/b27-17-/t23-,40-,41+,42+,43+,44+/m1/s1
SMILESC[C@@]12CC3=C(CCC([O-])=O)[C@](C)(CC([O-])=O)C(\C=C4/N[C@@](C)(C5=C(CC([O-])=O)[C@@](C)(CCC([O-])=O)C(CC(=N1)C(CCC([O-])=O)=C2CC([O-])=O)=N5)[C@@](C)(CC([O-])=O)[C@@H]4CCC([O-])=O)=[NH+]3
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:77872
chebi:77872
precorrin-6A
precorrin-6A(7-)
bigg.metabolite:pre6a
biggM:pre6a
Precorrin 6A
seed.compound:cpd03761
seedM:cpd03761
Precorrin 6A
Precorrin 6X
pre6a
precorrin-6A
precorrin-6x
kegg.compound:C06320
keggC:C06320
Precorrin 6X
Precorrin 6A
metacyc.compound:CPD-675
metacycM:CPD-675
precorrin-6A
precorrin-6x
CHEBI:58513
chebi:58513
precorrin-6X(8-)
3,3',3'',3'''-[(1R,2S,3S,7S,11S,17R)-2,7,12,18-tetrakis(carboxylatomethyl)-1,2,7,11,17-pentamethyl-18,19-didehydrocorrin-3,8,13,17-tetrayl]tetrapropanoate
CHEBI:27513
chebi:27513
precorrin-6X
3,3',3'',3'''-[(1R,2S,3S,7S,11S,17R)-2,7,12,18-tetrakis(carboxymethyl)-1,2,7,11,17-pentamethyl-18,19-didehydrocorrin-3,8,13,17-tetrayl]tetrapropanoic acid
Precorrin 6A
Precorrin 6X
chebi:14875
chebi:26225
chebi:8375
biggM:M_pre6a
keggC:M_C06320
seedM:M_cpd03761
secondary/obsolete/fantasy identifier