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Phenylpropanoids

Fmoc-O-(benzylphospho)-L-threonine

Fmoc-苏氨酸磷酸苄酯

PHY-NP-14237 · Natural product research catalog

Catalog numberPHY-NP-14237
CAS number175291-56-2
Molecular formulaC26H26NO8P
Molecular weight511.467 g/mol
Chemical classPhenylpropanoids
Purity / assayConfirmed in quotation and batch COA

Chemical structure

Chemical structure of Fmoc-O-(benzylphospho)-L-threonine

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Product information

Fmoc-O-(benzylphospho)-L-threonine is listed in the Phenylpropanoids 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(2S,3R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[hydroxy(phenylmethoxy)phosphoryl]oxybutanoic acid
SMILESC[C@@H]([C@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)OP(=O)(O)OCC4=CC=CC=C4
InChIKeyHOFDVXHILSPFNS-BXKMTCNYSA-N
PubChem CID15224585

Computed properties & structure classification

Exact mass (Da)511.1396Predicted LogP4.7006
Predicted TPSA (Ų)131.39H-bond donors3
H-bond acceptors6Rotatable bonds10
Ring count4Aromatic rings3
Fraction Csp³0.231Synthetic accessibility score3.48
QED score0.334Lipinski rule violations1
NPClassifier pathwayShikimates and PhenylpropanoidsParent SMILESC[C@H](OP(=O)(O)OCc1ccccc1)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
Parent formulaC26H26NO8PParent molecular weight511.467
Specified stereocenters2Unspecified stereocenters1

Structure-derived values from the supplied dataset; not measured batch specifications or experimentally verified activity.

Reported natural occurrence

LOTUS species records0
LOTUS reference records0
COCONUT organism records0

Occurrence records are inherited from the supplied dataset. They do not establish manufacturing origin, batch traceability or independent literature verification. Taxonomic names may include synonyms.

Documents & specifications

Certificate of analysis (COA)Batch-specific document pending; not available in this preview
Safety data sheet (SDS)Not yet published
Storage / solubilityProduct-specific conditions to be confirmed
ShippingConfirmed with the quotation

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