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Anecortave Acetate

CAT: 0013-GTR19173552-04Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19173552-04Size:100 mg
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Description
Anecortave Acetate (NSC-24345) is an angiostatic steroid employed in proteomics and angiogenesis research. It is utilized in both in vitro and in vivo experimental models to study its mechanism of action in inhibiting new blood vessel formation, relevant to conditions like age-related macular degeneration.
CAS Number
7753-60-8
Product Name Alternative
NSC24345, NSC-24345, NSC15475, NSC-15475, NSC 15475, NSC 24345, Anecortave, Anecortave Acetate, Al 3789, Retaane
Field of Research
Metabolism Research, Pharmacology & Drug Discovery
Purity
98.93% (May vary between batches)
Solubility
H2O:Insoluble; DMSO:< 1 mg/mL (insoluble or slightly soluble)
Smiles
C[C@@]12[C@] ([C@]3 (C ([C@]4 (C) C (CC3) =CC (=O) CC4) =CC1) [H]) (CC[C@@]2 (C (COC (C) =O) =O) O) [H]
Molecular Formula
C23H30O5
Molecular Weight
386.48
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Anecortave Acetate

Anecortave acetate is an organic molecular entity.

CAS Number7753-60-8
PubChem CID111332
IUPAC Name[2-[(8S,10S,13S,14S,17R)-17-hydroxy-10,13-dimethyl-3-oxo-2,6,7,8,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Molecular FormulaC23H30O5
Molecular Weight386.5
XLogP2.1
Topological Polar Surface Area80.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count28
Formal Charge0
Complexity808
SMILES
CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(CC=C3[C@H]2CCC4=CC(=O)CC[C@@]43C)C)O
InChI
InChI=1S/C23H30O5/c1-14(24)28-13-20(26)23(27)11-8-19-17-5-4-15-12-16(25)6-9-21(15,2)18(17)7-10-22(19,23)3/h7,12,17,19,27H,4-6,8-11,13H2,1-3H3/t17-,19+,21+,22+,23+/m1/s1
InChIKey
YUWPMEXLKGOSBF-GACAOOTBSA-N
Chemical Structure
2D Structure
2D structure of Anecortave Acetate
CAS: 7753-60-8
CID: 111332
Formula: C23H30O5
MW: 386.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight386.5
XLogP32.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass386.20932405
Monoisotopic Mass386.20932405
Topological Polar Surface Area80.7 Ų
Heavy Atom Count28
Formal Charge0
Complexity808
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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