Products for Research Use Only
RegisterLogin

(S)-FTY-720 Vinylphosphonate

CAT: 0572-TRC-F810380-25MGSize: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0572-TRC-F810380-25MGSize:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1142015-13-1
Synonyms
P-[(1E,3S)-3-Amino-3-(hydroxymethyl)-5-(4-octylphenyl)-1-penten-1-yl]phosphonic Acid
Hazard Statement
No Data Available
Smiles
OC[C@](/C=C/P(O)(O)=O)(N)CCC1=CC=C(CCCCCCCC)C=C1
Molecular Formula
C20H34NO4P
Molecular Weight
383.46
InChI
InChI=1S/C20H34NO4P/c1-2-3-4-5-6-7-8-18-9-11-19(12-10-18)13-14-20(21,17-22)15-16-26(23,24)25/h9-12,15-16,22H,2-8,13-14,17,21H2,1H3,(H2,23,24,25)/b16-15+/t20-/m0/s1
Additionnal Information
IUPAC name: (S,E)-(3-amino-3-(hydroxymethyl)-5-(4-octylphenyl)pent-1-en-1-yl)phosphonic acid
Shipping Conditions
Room Temperature

Chemical Information

(S)-FTY-720 Vinylphosphonate
CAS Number1142015-13-1
PubChem CID42611957
IUPAC Name[(E,3S)-3-amino-3-(hydroxymethyl)-5-(4-octylphenyl)pent-1-enyl]phosphonic acid
Molecular FormulaC20H34NO4P
Molecular Weight383.5
XLogP0.9
Topological Polar Surface Area104
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count13
Heavy Atom Count26
Formal Charge0
Complexity443
SMILES
CCCCCCCCC1=CC=C(C=C1)CC[C@@](CO)(/C=C/P(=O)(O)O)N
InChI
InChI=1S/C20H34NO4P/c1-2-3-4-5-6-7-8-18-9-11-19(12-10-18)13-14-20(21,17-22)15-16-26(23,24)25/h9-12,15-16,22H,2-8,13-14,17,21H2,1H3,(H2,23,24,25)/b16-15+/t20-/m0/s1
InChIKey
YWQUROWPKWKDNA-APHAIJBRSA-N
Chemical Structure
2D Structure
2D structure of (S)-FTY-720 Vinylphosphonate
CAS: 1142015-13-1
CID: 42611957
Formula: C20H34NO4P
MW: 383.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight383.5
XLogP30.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count13
Exact Mass383.22254556
Monoisotopic Mass383.22254556
Topological Polar Surface Area104 Ų
Heavy Atom Count26
Formal Charge0
Complexity443
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
TRC-F810385-25MG(R)-FTY-720 Vinylphosphonate
TRC-F810390-25MG(S)-FTY-720 Phosphonate
TRC-F810395-25MG(R)-FTY-720 Phosphonate
TRC-N381313-50MG(S,S,S,S)-Nebivolol
TRC-T713490-1GS,S,S,S,S-Trandolapril Hydrochloride
TRC-C490005-100MG(+)-(S,S,S)-Ciramadol
TRC-A729780-25MG(S,S,S)-Aprepitant
TRC-O686485-1MG(S,R,S,S)-Orlistat
TRC-O686485-2MG(S,R,S,S)-Orlistat
TRC-E555250-100MG(S,S,S)-Enalapril Maleate

Alternative Products

CatalogName
HY-12898(S) -FTY-720 Vinylphosphonate
465626-01S-FTY-720 Vinylphosphonate
MBS5813931(S)-FTY-720 Vinylphosphonate
463970-01(R) -FTY-720 Vinylphosphonate
MBS5813930(R)-FTY-720 Vinylphosphonate
465625-01S-FTY-720 Phosphonate
BML-SL233-0025FTY-720 . HCl
C17692Fingolimod (FTY-720)
6176/10FTY 720 10 mg
6176/50FTY 720 50 mg

Popular Products