Products for Research Use Only
RegisterLogin

Desmosine TFA Salt

CAT: 0572-TRC-D296794-25MGSize: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0572-TRC-D296794-25MGSize:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1574508-37-4
Synonyms
Desmosine (Amino Acid) TFA Salt; 4-[(4S)-4-Amino-4-carboxybutyl]-1-[(5S)-5-amino-5-carboxypentyl]-3,5-bis[(3S)-3-amino-3-carboxypropyl]pyridinium TFA Salt;
Hazard Statement
No Data Available
Smiles
OC(C(F)(F)F)=O.O=C([C@@H](N)CCC1=C(CCC[C@H](N)C(O)=O)C(CC[C@H](N)C(O)=O)=C[N+](CCCC[C@H](N)C(O)=O)=C1)O
Molecular Formula
C24H40N5O8 • ( C2HF3O2)
Molecular Weight
640.63
InChI
InChI=1S/C24H39N5O8.C2HF3O2/c25-17(21(30)31)5-1-2-11-29-12-14(7-9-19(27)23(34)35)16(4-3-6-18(26)22(32)33)15(13-29)8-10-20(28)24(36)37;3-2(4,5)1(6)7/h12-13,17-20H,1-11,25-28H2,(H3-,30,31,32,33,34,35,36,37);(H,6,7)/p+1/t17-,18-,19-,20-;/m0./s1
Additionnal Information
IUPAC name: 2,2,2-trifluoroacetic acid, 3,5-bis((S)-3-amino-3-carboxypropyl)-4-((S)-4-amino-4-carboxybutyl)-1-((S)-5-amino-5-carboxypentyl)pyridin-1-ium salt
Shipping Conditions
Room Temperature

Chemical Information

Desmosine TFA Salt
CAS Number1574508-37-4
PubChem CID171382073
IUPAC Name(2S)-2-amino-6-[4-[(4S)-4-amino-4-carboxybutyl]-3,5-bis[(3S)-3-amino-3-carboxypropyl]pyridin-1-ium-1-yl]hexanoic acid;2,2,2-trifluoroacetic acid
Molecular FormulaC26H41F3N5O10+
Molecular Weight640.6
Topological Polar Surface Area294
Hydrogen Bond Donor Count9
Hydrogen Bond Acceptor Count17
Rotatable Bond Count19
Heavy Atom Count44
Formal Charge1
Complexity804
SMILES
C1=C(C(=C(C=[N+]1CCCC[C@@H](C(=O)O)N)CC[C@@H](C(=O)O)N)CCC[C@@H](C(=O)O)N)CC[C@@H](C(=O)O)N.C(=O)(C(F)(F)F)O
InChI
InChI=1S/C24H39N5O8.C2HF3O2/c25-17(21(30)31)5-1-2-11-29-12-14(7-9-19(27)23(34)35)16(4-3-6-18(26)22(32)33)15(13-29)8-10-20(28)24(36)37;3-2(4,5)1(6)7/h12-13,17-20H,1-11,25-28H2,(H3-,30,31,32,33,34,35,36,37);(H,6,7)/p+1/t17-,18-,19-,20-;/m0./s1
InChIKey
MXSFACIJSIBZPW-NAACWRBGSA-O
Chemical Structure
2D Structure
2D structure of Desmosine TFA Salt
CAS: 1574508-37-4
CID: 171382073
Formula: C26H41F3N5O10+
MW: 640.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight640.6
Hydrogen Bond Donor Count9
Hydrogen Bond Acceptor Count17
Rotatable Bond Count19
Exact Mass640.28055201
Monoisotopic Mass640.28055201
Topological Polar Surface Area294 Ų
Heavy Atom Count44
Formal Charge1
Complexity804
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

Related Products

CatalogName
TRC-D296847-1MGDesmosine-d4 (major) Inner Salt
TRC-D296847-10MGDesmosine-d4 (major) Inner Salt
TRC-P574770-50MGPHMB-A TFA Salt
TRC-S142630-50MGSaralasin TFA Salt
TRC-P211010-5MGPasireotide TFA Salt
O703584Orsaponin TFA Salt
TRC-A726115-1MGApamin TFA Salt
TRC-D281938-5MGDermenkephalin TFA Salt
TRC-P285305-100MGPeramine TFA Salt
TRC-G596628-10MGGalnon TFA Salt

Alternative Products

CatalogName
900125Desmosine
YP-W34922-01Rat Desmosine (Desmosine) ELISA Kit
008739-01Desmosine Chloride
900125BADesmosine-BSA
900125KHDesmosine-KLH
770012Desmosine ELISA Kit
MBS751798-01Rabbit Desmosine ELISA Kit
MBS746186-01Bovine Desmosine ELISA Kit
MBS021657-01Sheep Desmosine ELISA Kit
MBS730011-01Human Desmosine ELISA Kit

Popular Products