Compound-ID | 6759 |
Common Name | Taurolithocholate sulfate |
Synonyms |
3alpha-Sulfatolithocholyltaurine
Taurolithocholic acid 3-sulfate |
InChI |
InChI=1S/C26H45NO8S2/c1-17(4-9-24(28)27-14-15-36(29,30)31)21-7-8-22-20-6-5-18-16-19(35-37(32,33)34)10-12-25(18,2)23(20)11-13-26(21,22)3/h17-23H,4-16H2,1-3H3,(H,27,28)(H,29,30,31)(H,32,33,34)/t17-,18-,19-,20+,21-,22+,23+,25+,26-/m1/s1
|
SMILES |
[H]C34(CCC1([H])(C([H])(CCC2(C)(C([H])(CCC12([H]))C(C)CCC(=O)NCCS(O)(=O)=O))C4(C)(CCC(C3)OS(=O)(O)=O)))
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External Links | |
KEGG-COMPOUND-ID |
C03642
|
PUBCHEM-ID | 6424 |
ChEBI-ID |
17864
|
BioModels |
17864 |
View all entries for compound: Taurolithocholate sulfate |