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Substance Name: Chenodeoxycholyltyrosine
RN: 103528-65-0
InChIKey: GADRVMPNTDRMDU-PFBPSXOCSA-N

Molecular Weight

  • 555.751
 
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Names and Synonyms

  • Chenodeoxycholyltyrosine

Registry Numbers

CAS Registry Number

  • 103528-65-0

System Generated Number

  • 0103528650

Structure Descriptors

InChI

1S/C33H49NO6/c1-19(4-11-29(38)34-27(31(39)40)16-20-5-7-22(35)8-6-20)24-9-10-25-30-26(13-15-33(24,25)3)32(2)14-12-23(36)17-21(32)18-28(30)37/h5-8,19,21,23-28,30,35-37H,4,9-18H2,1-3H3,(H,34,38)(H,39,40)/t19-,21+,23-,24-,25?,26?,27+,28-,30?,32+,33-/m1/s1

InChIKey

GADRVMPNTDRMDU-PFBPSXOCSA-N

Smiles

C([C@@H](NC(CC[C@H]([C@H]1CC[C@@H]2[C@@H]3[C@@H](C[C@@H]4C[C@@H](CC[C@@]4([C@@H]3CC[C@@]12C)C)O)O)C)=O)Cc1ccc(O)cc1)(=O)O