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Steroids

Murideoxycholic acid

鼠脱氧胆酸

PHY-NP-10851 · Natural product research catalog

Catalog numberPHY-NP-10851
CAS number668-49-5
Molecular formulaC24H40O4
Molecular weight392.58 g/mol
Chemical classSteroids
Main reported sourceHomo sapiens
Purity / assayMin. 98%
Other purity specifications available on inquiry.

Chemical structure

Chemical structure of Murideoxycholic acid

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Product information

Murideoxycholic acid is listed in the Steroids section of the Phytide Bio research catalog. Standard pack sizes are 5, 10, 20, 50 and 100 mg.

For research use only. Not for human or veterinary use, diagnosis or treatment.

Names & identifiers

IUPAC name(4R)-4-[(3R,5R,6R,8S,9S,10R,13R,14S,17R)-3,6-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
SMILESC[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)C
InChIKeyDGABKXLVXPYZII-PLYQRAMGSA-N
Subclass / scaffoldCholane steroids
PubChem CID5283821

Computed properties

Exact mass (Da)392.2927Predicted LogP4.4779
Predicted TPSA (Ų)77.76H-bond donors3
H-bond acceptors3Rotatable bonds4

Calculated values from the supplied dataset; not measured batch specifications.

View additional properties & classification
Ring count4
Aromatic rings0
Fraction Csp³0.958
Synthetic accessibility score4.35
QED score0.659
Lipinski rule violations0
NPClassifier pathwayTerpenoids
NPClassifier superclassSteroids
NPClassifier classCholane steroids
Parent SMILESC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3C[C@@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
Parent formulaC24H40O4
Parent molecular weight392.58
Specified stereocenters10
Unspecified stereocenters0

Reported natural occurrence

Main reported sourceHomo sapiens
Reported source familiesHominidae; Muridae

Reported natural occurrence does not establish the manufacturing origin of the supplied material.

View occurrence records & references
LOTUS / Wikidata speciesHomo sapiens[1]; house mouse[1]
All reported source familiesHominidae[1]; Muridae[1]
LOTUS species records2
LOTUS reference records2
COCONUT occurrence recordsHomo sapiens; house mouse
COCONUT organism records2
COCONUT identifierCNP0188776.2

Records are inherited from the supplied dataset and are not independently verified. Taxonomic names may include synonyms.

Documents & specifications

Certificate of analysis (COA)Batch-specific COA available on request; no PDF published yet
Safety data sheet (SDS)Not yet published
Storage / solubilityProduct-specific conditions to be confirmed
ShippingConfirmed with the quotation

Request applicable documentation and handling information before ordering or use.