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Triamcinolone 21-Acetate

CAT: 0572-TRC-T767290-25MGSize: 25 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-T767290-25MGSize:25 mg
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CAS Number
3859-65-2
Synonyms
(11beta,16alpha)-21-(Acetyloxy)-9-fluoro-11,16,17-trihydroxy-pregna-1,4-diene-3,20-dione; 9-Fluoro-11beta,16alpha,17,21-trihydroxypregna-1,4-diene-3,20-dione 21-Acetate
Hazard Statement
Harmful if swallowed
Purity
>95% (HPLC)
Smiles
CC(=O)OCC(=O)[C@@]1(O)[C@H](O)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C
Molecular Formula
C23H29FO7
Molecular Weight
436.47
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Triamcinolone 21-Acetate
CAS Number3859-65-2
PubChem CID22793126
IUPAC Name[2-[(8S,9R,10S,11S,13S,14S,16R,17S)-9-fluoro-11,16,17-trihydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Molecular FormulaC23H29FO7
Molecular Weight436.5
XLogP1.2
Topological Polar Surface Area121
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count31
Formal Charge0
Complexity912
SMILES
CC(=O)OCC(=O)[C@]1([C@@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C)O)O
InChI
InChI=1S/C23H29FO7/c1-12(25)31-11-19(29)23(30)17(27)9-16-15-5-4-13-8-14(26)6-7-20(13,2)22(15,24)18(28)10-21(16,23)3/h6-8,15-18,27-28,30H,4-5,9-11H2,1-3H3/t15-,16-,17+,18-,20-,21-,22-,23-/m0/s1
InChIKey
IQFJTDLERMTRLJ-QZUYBKCWSA-N
Chemical Structure
2D Structure
2D structure of Triamcinolone 21-Acetate
CAS: 3859-65-2
CID: 22793126
Formula: C23H29FO7
MW: 436.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight436.5
XLogP31.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass436.18973142
Monoisotopic Mass436.18973142
Topological Polar Surface Area121 Ų
Heavy Atom Count31
Formal Charge0
Complexity912
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
DAA85965-01Triamcinolone 21-acetate
sc-3941329-Chloro Triamcinolone Acetonide 21-Acetate
AR-T02909-01Triamcinolone Acetonide EP Impurity F (Triamcinolone Acetonide 21-Acetate)
CS-O-46259Triamcinolone 21-succinate
PC110931-01Triamcinolone acetonide acetate
RM-T180921-01Triamcinolone Impurity 21
sc-49969321-Dehydro Triamcinolone
00150621- (Acetyloxy) Triamcinolone Acetonide
sc-474800Triamcinolone 16,21-Diacetate
HY-W340872R-01Triamcinolone acetonide acetate (Standard)

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