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Glycochenodeoxycholate

MNXM8391 is deprecated and here replaced by MNXM732861
!!! Alternative mappings exist !!!
PropertiesImageOccurences in reactions
MNX_IDMNXM732861Image of MNXM732861
#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 4
formulaC26H42NO5
charge-1
mass448.30685
referencebiggM:gdchola
InChIKeyGHCZAUBVMUEKKP-ZITKRNEBSA-M
InChIInChI=1S/C26H43NO5/c1-15(4-7-22(30)27-14-23(31)32)18-5-6-19-24-20(9-11-26(18,19)3)25(2)10-8-17(28)12-16(25)13-21(24)29/h15-21,24,28-29H,4-14H2,1-3H3,(H,27,30)(H,31,32)/p-1/t15-,16-,17+,18+,19?,20?,21+,24?,25-,26+/m0/s1
SMILESC[C@@H](CCC(=O)NCC(=O)[O-])[C@H]1CCC2C3C(CC[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
bigg.metabolite:gdchola
biggM:gdchola 		Glycochenodeoxycholate
biggM:M_gdchola secondary/obsolete/fantasy identifier