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Dehydroandrographolide Succinate Potasium Salt

CAT: 0957-S3774-01Size: 25 mgDry Ice: YesHazardous: No
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CAT#:0957-S3774-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Dehydroandrographolide Succinate (DAS), extracted from herbal medicine Andrographis paniculata (Burm f) Nees, is widely used for the treatment of viral pneumonia and viral upper respiratory tract infections because of its immunostimulatory, anti-infective and anti-inflammatory effect.
CAS Number
76958-99-1
Target
Immunology & Inflammation related
Activity
Immunology & Inflammation
Molecular Formula
C28H35O10.K
Storage Conditions
2 years -80 in solvent

Chemical Information

14-Deoxy-11,12-didehydroandrographolide 3,19-disuccinate

structure given in first source

CAS Number76958-99-1
PubChem CID23685777
IUPAC Namepotassium 4-[[(1R,2R,4aR,5R,8aS)-2-(3-carboxypropanoyloxy)-1,4a-dimethyl-6-methylidene-5-[(E)-2-(5-oxo-2H-furan-4-yl)ethenyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methoxy]-4-oxobutanoate
Molecular FormulaC28H35KO10
Molecular Weight570.7
Topological Polar Surface Area156
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count13
Heavy Atom Count39
Formal Charge0
Complexity1060
SMILES
C[C@@]12CC[C@H]([C@@]([C@H]1CCC(=C)[C@H]2/C=C/C3=CCOC3=O)(C)COC(=O)CCC(=O)[O-])OC(=O)CCC(=O)O.[K+]
InChI
InChI=1S/C28H36O10.K/c1-17-4-7-20-27(2,19(17)6-5-18-13-15-36-26(18)35)14-12-21(38-25(34)11-9-23(31)32)28(20,3)16-37-24(33)10-8-22(29)30;/h5-6,13,19-21H,1,4,7-12,14-16H2,2-3H3,(H,29,30)(H,31,32);/q;+1/p-1/b6-5+;/t19-,20+,21-,27+,28+;/m1./s1
InChIKey
ASSFASHREXZFDB-IPPKWHAOSA-M
Chemical Structure
2D Structure
2D structure of 14-Deoxy-11,12-didehydroandrographolide 3,19-disuccinate
CAS: 76958-99-1
CID: 23685777
Formula: C28H35KO10
MW: 570.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight570.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count13
Exact Mass570.18672879
Monoisotopic Mass570.18672879
Topological Polar Surface Area156 Ų
Heavy Atom Count39
Formal Charge0
Complexity1060
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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BDA95899-01Dehydroandrographolide Succinate Potasium Salt
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