Carbenoxolone disodium

CAT: 0607-A8389-5.1Size: 10 mM (in 1mL DMSO)Dry Ice: NoHazardous: No

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CAT#:0607-A8389-5.1Size:10 mM (in 1mL DMSO)

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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Description

11β-HSD inhibitor

CAS Number

7421-40-1

Product Name Alternative

disodium;10-(3-carboxylatopropanoyloxy)-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carboxylate

Field of Research

Neuroscience Gap Junction

Purity

0.9985

Form

A solid

Solubility

≥30.74 mg/mL in DMSO; ≥39.1 mg/mL in EtOH; ≥55.1 mg/mL in H2O

Smiles

CC1(C2CCC3(C(C2(CCC1OC(=O)CCC(=O)[O-])C)C(=O)C=C4C3(CCC5(C4CC(CC5)(C)C(=O)[O-])C)C)C)C.[Na+].[Na+]

Molecular Formula

C34H48Na2O7

Molecular Weight

614.72

Shipping Conditions

Blue ice

Storage Conditions

Store at -20°C.

Chemical Information

Carbenoxolone Sodium

Carbenoxolone sodium is a triterpenoid.

CAS Number	7421-40-1
PubChem CID	636402
IUPAC Name	disodium;(2S,4aS,6aR,6aS,6bR,8aR,10S,12aS,14bR)-10-(3-carboxylatopropanoyloxy)-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carboxylate
Molecular Formula	C34H48Na2O7
Molecular Weight	614.7
Topological Polar Surface Area	124
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	4
Heavy Atom Count	43
Formal Charge	0
Complexity	1190

SMILES

C[C@]12CC[C@](C[C@H]1C3=CC(=O)[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)OC(=O)CCC(=O)[O-])C)(C)C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C34H50O7.2Na/c1-29(2)23-10-13-34(7)27(32(23,5)12-11-24(29)41-26(38)9-8-25(36)37)22(35)18-20-21-19-31(4,28(39)40)15-14-30(21,3)16-17-33(20,34)6;;/h18,21,23-24,27H,8-17,19H2,1-7H3,(H,36,37)(H,39,40);;/q;2*+1/p-2/t21-,23-,24-,27+,30+,31-,32-,33+,34+;;/m0../s1

InChIKey

BQENDLAVTKRQMS-SBBGFIFASA-L

Chemical Structure

2D Structure

CAS: 7421-40-1

CID: 636402

Formula: C34H48Na2O7

MW: 614.7

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	614.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	4
Exact Mass	614.31954243
Monoisotopic Mass	614.31954243
Topological Polar Surface Area	124 Å²
Heavy Atom Count	43
Formal Charge	0
Complexity	1190
Isotope Atom Count	0
Defined Atom Stereocenter Count	9
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	3
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
HY-B1367-01	Carbenoxolone (disodium)
MBS6025764-01	Carbenoxolone Disodium
TBW01561	Carbenoxolone

Carbenoxolone disodium

Chemical Information

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