Products for Research Use Only
RegisterLogin

Triamcinolone-13C3 Acetonide

CAT: 0572-TRC-T767167-10MGSize: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0572-TRC-T767167-10MGSize:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1264131-86-3
Hazard Statement
Harmful if swallowed
Purity
>95% (HPLC)
Smiles
[13CH3][13C]1([13CH3])O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@@]5(C)[C@]4(F)[C@@H](O)C[C@@]3(C)[C@]2(O1)C(=O)CO
Molecular Formula
C21 13C3 H31 F O6
Molecular Weight
437.482
InChI
InChI=1S/C24H31FO6/c1-20(2)30-19-10-16-15-6-5-13-9-14(27)7-8-21(13,3)23(15,25)17(28)11-22(16,4)24(19,31-20)18(29)12-26/h7-9,15-17,19,26,28H,5-6,10-12H2,1-4H3/t15-,16-,17-,19+,21-,22-,23-,24+/m0/s1/i1+1,2+1,20+1
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Triamcinolone-13C3 Acetonide
CAS Number1264131-86-3
PubChem CID46783137
IUPAC Name(1S,9S,11S,13S)-12-fluoro-11-hydroxy-8-(2-hydroxyacetyl)-9,13-dimethyl-6,6-di((113C)methyl)-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one
Molecular FormulaC24H31FO6
Molecular Weight437.5
XLogP2.5
Topological Polar Surface Area93.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count2
Heavy Atom Count31
Formal Charge0
Complexity925
SMILES
C[C@]12C[C@@H](C3([C@H](C1CC4C2(O[13C](O4)([13CH3])[13CH3])C(=O)CO)CCC5=CC(=O)C=C[C@@]53C)F)O
InChI
InChI=1S/C24H31FO6/c1-20(2)30-19-10-16-15-6-5-13-9-14(27)7-8-21(13,3)23(15,25)17(28)11-22(16,4)24(19,31-20)18(29)12-26/h7-9,15-17,19,26,28H,5-6,10-12H2,1-4H3/t15-,16?,17-,19?,21-,22-,23?,24?/m0/s1/i1+1,2+1,20+1
InChIKey
YNDXUCZADRHECN-NULWQFMMSA-N
Chemical Structure
2D Structure
2D structure of Triamcinolone-13C3 Acetonide
CAS: 1264131-86-3
CID: 46783137
Formula: C24H31FO6
MW: 437.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight437.5
XLogP32.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count2
Exact Mass437.22053137
Monoisotopic Mass437.22053137
Topological Polar Surface Area93.1 Ų
Heavy Atom Count31
Formal Charge0
Complexity925
Isotope Atom Count3
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count4
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
TRC-T767165-25GTriamcinolone Acetonide
TRC-T767165-1GTriamcinolone Acetonide
TRC-T767165-50MGTriamcinolone Acetonide
TRC-A187420-1MG21-(Acetyloxy) Triamcinolone Acetonide
TRC-C421680-5MG9-Chloro Triamcinolone Acetonide
TRC-H970050-5MG6Beta-Hydroxy Triamcinolone Acetonide
TRC-C421680-10MG9-Chloro Triamcinolone Acetonide
TRC-H970050-10MG6Beta-Hydroxy Triamcinolone Acetonide
TRC-T767168-10MGTriamcinolone Acetonide-d7 (major)
TRC-M268855-100MG21-Methoxy Triamcinolone Acetonide

Alternative Products

CatalogName
sc-220322Triamcinolone-13C3 Acetonide
HY-B0636S1-01Triamcinolone acetonide-13C3
A8540-250Triamcinolone Acetonide

Popular Products