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Caudatin

CAT: 1410-M18501-04Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1410-M18501-04Size:25 mg
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Description
Caudatin is one of the species of C-21 steroidal glycosides mainly isolated from the root of Cynanchum bungei Decne and exhibits potent anticancer activities.
CAS Number
38395-02-7
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
490.63
Molecular Formula
C28H42O7
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

Caudatin

(1S,3aR,3bS,7S,9aR,9bR,11R,11aS)-1-acetyl-1,3a,3b,7-tetrahydroxy-9a,11a-dimethyl-2H,3H,4H,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-11-yl (2E)-3,4-dimethylpent-2-enoate has been reported in Araujia sericifera with data available.

CAS Number38395-02-7
PubChem CID21633059
IUPAC Name[(3S,8S,9R,10R,12R,13S,14R,17S)-17-acetyl-3,8,14,17-tetrahydroxy-10,13-dimethyl-1,2,3,4,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-12-yl] (E)-3,4-dimethylpent-2-enoate
Molecular FormulaC28H42O7
Molecular Weight490.6
XLogP2.4
Topological Polar Surface Area124
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count35
Formal Charge0
Complexity984
SMILES
CC(C)/C(=C/C(=O)O[C@@H]1C[C@@H]2[C@]3(CC[C@@H](CC3=CC[C@]2([C@@]4([C@]1([C@@](CC4)(C(=O)C)O)C)O)O)O)C)/C
InChI
InChI=1S/C28H42O7/c1-16(2)17(3)13-23(31)35-22-15-21-24(5)9-8-20(30)14-19(24)7-10-27(21,33)28(34)12-11-26(32,18(4)29)25(22,28)6/h7,13,16,20-22,30,32-34H,8-12,14-15H2,1-6H3/b17-13+/t20-,21+,22+,24-,25+,26+,27-,28+/m0/s1
InChIKey
VWLXIXALPNYWFH-UXGQNDOZSA-N
Chemical Structure
2D Structure
2D structure of Caudatin
CAS: 38395-02-7
CID: 21633059
Formula: C28H42O7
MW: 490.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight490.6
XLogP32.4
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass490.29305367
Monoisotopic Mass490.29305367
Topological Polar Surface Area124 Ų
Heavy Atom Count35
Formal Charge0
Complexity984
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
TB0213Caudatin
A14775-25Caudatin 25mg
HY-N1983RCaudatin (Standard)
A14775-100Caudatin 100mg
A14775-50Caudatin 50mg
A14775-200Caudatin 200mg
A14775-1Caudatin 1mg
A14775-10Caudatin 10mg
A14775-5Caudatin 5mg
A14775-10mM-DCaudatin 10mM * 1mL in DMSO

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