(Q7688896)

English

taurodeoxycholic acid

chemical compound

Tudcabil
Sodium taurodeoxycholate
Taurodeoxycholic acid sodium salt
Deoxytaurocholic acid
Deoxycholyltaurine
Taurodesoxycholic acid
Taurodeoxycholic acid sodium salt hydrate
2-[(4R)-4-[(1S,2S,5R,7R,10R,11S,14R,15R,16S)-5,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-yl]pentanamido]ethane-1-sulfonic acid
N-(3a,12a-Dihydroxy-5b-cholan-24-oyl)-Taurine
Taurodesoxycholate
Sodium taurodeoxylate
Deoxytaurocholate

In more languages

default for all languages

No label defined

No description defined

Statements

type of chemical entity

0 references

0 references

4-[(1R,3aS,3bR,5aR,7R,9aS,9bS,11S,11aR)-7,11-dihydroxy-9a,11a-dimethyl-tetradecahydro-1H-cyclopenta[a]phenanthren-1-yl]-N-(2-sulfoethyl)pentanimidic acid

1 reference

based on heuristic

inferred from SMILES

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

chemical structure

Taurodeoxycholic acid.png
1,680 × 789; 22 KB

0 references

499.297 dalton

1 reference

language of work or name

Tudcabil (English)

19 October 2016

chemical formula

C₂₆H₄₅NO₆S

1 reference

language of work or name

Tudcabil (English)

19 October 2016

canonical SMILES

CC(CCC(=O)NCCS(=O)(=O)O)C1CCC2C1(C(CC3C2CCC4C3(CCC(C4)O)C)O)C

1 reference

language of work or name

Tudcabil (English)

19 October 2016

isomeric SMILES

C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C

1 reference

language of work or name

Tudcabil (English)

19 October 2016

2 references

A community-driven global reconstruction of human metabolism.

Recon 2.2: from reconstruction to model of human metabolism

Streptomyces nigra

1 reference

Streptomyces nigra sp. nov. Is a Novel Actinobacterium Isolated From Mangrove Soil and Exerts a Potent Antitumor Activity in Vitro

Caenorhabditis elegans

1 reference

Modeling Meets Metabolomics-The WormJam Consensus Model as Basis for Metabolic Studies in the Model Organism

subject has role

cholagogues and choleretics

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

Identifiers

InChI=1S/C26H45NO6S/c1-16(4-9-24(30)27-12-13-34(31,32)33)20-7-8-21-19-6-5-17-14-18(28)10-11-25(17,2)22(19)15-23(29)26(20,21)3/h16-23,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33)/t16-,17-,18-,19+,20-,21+,22+,23+,25+,26-/m1/s1

1 reference

language of work or name

Tudcabil (English)

19 October 2016

AWDRATDZQPNJFN-VAYUFCLWSA-N

2 references

language of work or name

Tudcabil (English)

19 October 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

language of work or name

taurodeoxycholic acid (English)

19 October 2016

AWDRATDZQPNJFN-VAYUFCLWSA-N

CAS Common Chemistry

8 April 2021

https://commonchemistry.cas.org/detail?cas_rn=516-50-7

1 reference

language of work or name

Taurodeoxycholic acid (English)

19 October 2016

2 references

language of work or name

Tudcabil (English)

19 October 2016

matched by identifier from

AWDRATDZQPNJFN-VAYUFCLWSA-N

Reaxys registry number

3228310

1 reference

language of work or name

taurodeoxycholic acid (English)

19 October 2016

mapping relation type

2 references

language of work or name

taurodeoxycholic acid (English)

19 October 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C26H45NO6S/c1-16(4-9-24(30)27-12-13-34(31,32)33)20-7-8-21-19-6-5-17-14-18(28)10-11-25(17,2)22(19)15-23(29)26(20,21)3/h16-23,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33)/t16-,17-,18-,19+,20-,21+,22+,23+,25+,26-/m1/s1

1 reference

language of work or name

DEOXY CHOLATE (English)

19 October 2016

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

AWDRATDZQPNJFN-VAYUFCLWSA-N

UniChem compound ID

1 reference

MassBank accession ID

MSBNK-BGC_Munich-RP006001

0 references

MSBNK-BGC_Munich-RP006002

0 references

MSBNK-BGC_Munich-RP006003

0 references

MSBNK-Metabolon-MT000071

0 references

MSBNK-Nihon_Univ-NU000781

0 references

MSBNK-Nihon_Univ-NU000782

0 references

MSBNK-Nihon_Univ-NU000783

0 references

MSBNK-Nihon_Univ-NU000784

0 references

MSBNK-Nihon_Univ-NU000785

0 references

splash10-0ikd-0047930000-8f9f65d8c1d3c8253501

0 references

splash10-03g0-0950300000-d3a559bd8c5ccd049d7b

0 references

splash10-001i-9545740000-d9a7750b1b579bd2bb05

0 references

DSSTox substance ID

1 reference

matched by identifier from

AWDRATDZQPNJFN-VAYUFCLWSA-N

DSSTOX compound identifier

DTXCID601011709

0 references

MeSH descriptor ID

subject named as

Taurodeoxycholic Acid

0 references

D02.455.326.146.100.850.875.900

0 references

D02.886.645.600.055.850.800.900

0 references

D04.210.500.105.225.272.925

0 references

D04.210.500.105.225.900.900

0 references

D04.210.500.221.430.342.900

0 references

D04.210.500.221.430.873.920

0 references

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

AWDRATDZQPNJFN-VAYUFCLWSA-N

2 references

Global Substance Registration System

language of work or name

taurodeoxycholic acid (English)

19 October 2016

matched by identifier from

AWDRATDZQPNJFN-VAYUFCLWSA-N

Probes And Drugs ID

0 references

1 reference

language of work or name

taurodeoxycholic acid (English)

19 October 2016

0 references

0 references

1 reference

6 April 2020

0 references

Microsoft Academic ID

0 references

PDB structure ID

1 reference

Protein Data Bank

PDB structure ID

language of work or name

5KEW (English)

19 October 2016

Sitelinks

Wikipedia(6 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)

Retrieved from "https://www.wikidata.org/w/index.php?title=Q7688896&oldid=2167397974"

NODES