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Chemical structure of azido-FTY720

GC42891

azido-FTY720

Also known as 2-amino-2-[2-(3-azido-4-octylphenyl)ethyl]propane-1,3-diol

FTY720 is a derivative of ISP-1 (myriocin), a fungal metabolite of the Chinese herb Iscaria sinclarii as well as a structural analog of sphingosine

ChemicalCAS881914-35-8MW348.5FormulaC19H32N4O2
CAS number
881914-35-8
Molecular weight
348.5
Formula
C19H32N4O2
Solubility
DMF： 20 mg/ml,DMSO： 20 mg/ml,Ethanol： 20 mg/ml,Ethanol：PBS (pH 7·2) (1：1)： ·2 mg/ml
InChIKey
FLPFGLNTCQQHNS-UHFFFAOYSA-N
Catalogue number
GC42891
Brand
GLPBIO
Computed properties PubChem CID 11508523 · XLogP 5.1 · TPSA 80.8 Ų · H-bond donors 3
XLogP
5.1
TPSA
80.8 Ų
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
13
Heavy atoms
25

SMILES CCCCCCCCC1=C(C=C(C=C1)CCC(CO)(CO)N)N=[N+]=[N-]

Computed descriptors from PubChem (CID 11508523), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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