Compound

taurodeoxycholate 3-sulfate

CHEBI:195625ChEBI

Structure

2D depiction · 3D model shown

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A generated conformer of taurodeoxycholate 3-sulfate — one low-energy arrangement PubChem computed, not a measured structure. Hydrogens are not drawn; the formula counts them.

Class: Organic compound, anion
Formula: C26H43NO9S2
Mass: 577.762 g/mol
Charge: -2
InChIKey: UCVGCHGIKFWAGH-VAYUFCLWSA-L
SMILES: [H][C@]12CC[C@]3([H])[C@]([H])(C[C@H](O)[C@@]4(C)[C@@]3([H])CC[C@]4([H])[C@H](C)CCC(=O)NCCS(=O)(=O)[O-])[C@@]1(C)CC[C@@H](OS(=O)(=O)[O-])C2
Look it up: ChEBI PubChem By InChIKey

Identity from ChEBI, geometry from PubChem. Not evidence.

What it touches on the way

Mechanistic reach

1 entity

1 entities reached.

0 reported hops1 assembled from the scaffold

SULT2A1ProteinUNIPROT:Q06520metabolized byInferred only24 paths24 endpoints

What the reference databases state

Statements

1 statement

1 statement · 1 reference database · Subject: taurodeoxycholate 3-sulfate · Sources: Rhea

Order

taurodeoxycholate 3-sulfate is metabolised by SULT2A1ProteinRhea RHEA:77211Inferred only

Reactions

1 reaction

taurodeoxycholate+3'-phosphoadenylyl sulfatetaurodeoxycholate 3-sulfate+adenosine 3',5'-bisphosphate+hydron
Catalysed by SULT2A1
Reaction pageLeft to rightBalance undeterminable
Rhea RHEA:77211CC BY 4.0Reference data

Other names

2 names

Resolves to: taurodeoxycholate 3-sulfate

Also called: taurodeoxycholate 3alpha-sulfate(2-)taurodeoxycholate 3α-sulfate(2−)