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Poricoic acid A

CAT: 0957-E0204-1mgSize: 1 mgDry Ice: NoHazardous: No
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CAT#:0957-E0204-1mgSize:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
137551-38-3
Target
AMPK
Applications
PI3K/Akt/mTOR
Molecular Formula
C31H46O5
Additionnal Information
Poricoic acid A is isolated from the surface layer of Poria cocos. Poricoic acid A activates AMPK to attenuate fibroblast activation and abnormal extracellular matrix remodelling in renal fibrosis. Poricoic acid A also is a modulator of tryptophan hydroxylase-1 (TPH-1) .
Storage Conditions
3 years -20°C powder

Chemical Information

Poricoic Acid A

Poricoic acid A is a secondary alcohol, a dicarboxylic acid and a tricyclic triterpenoid. It has a role as a fungal metabolite.

CAS Number137551-38-3
PubChem CID5471851
IUPAC Name(2R)-2-[(2R,3R,3aR,6S,7S,9bR)-6-(2-carboxyethyl)-2-hydroxy-3a,6,9b-trimethyl-7-prop-1-en-2-yl-1,2,3,4,7,8-hexahydrocyclopenta[a]naphthalen-3-yl]-6-methyl-5-methylideneheptanoic acid
Molecular FormulaC31H46O5
Molecular Weight498.7
XLogP6.4
Topological Polar Surface Area94.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Heavy Atom Count36
Formal Charge0
Complexity1000
SMILES
CC(C)C(=C)CC[C@H]([C@H]1[C@@H](C[C@@]2([C@@]1(CC=C3C2=CC[C@H]([C@]3(C)CCC(=O)O)C(=C)C)C)C)O)C(=O)O
InChI
InChI=1S/C31H46O5/c1-18(2)20(5)9-10-21(28(35)36)27-25(32)17-31(8)24-12-11-22(19(3)4)29(6,15-14-26(33)34)23(24)13-16-30(27,31)7/h12-13,18,21-22,25,27,32H,3,5,9-11,14-17H2,1-2,4,6-8H3,(H,33,34)(H,35,36)/t21-,22+,25-,27+,29+,30-,31+/m1/s1
InChIKey
KVAQLXUMUVEKGR-SMFZDKLCSA-N
Chemical Structure
2D Structure
2D structure of Poricoic Acid A
CAS: 137551-38-3
CID: 5471851
Formula: C31H46O5
MW: 498.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight498.7
XLogP36.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Exact Mass498.33452456
Monoisotopic Mass498.33452456
Topological Polar Surface Area94.8 Ų
Heavy Atom Count36
Formal Charge0
Complexity1000
Isotope Atom Count0
Defined Atom Stereocenter Count7
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
MBS5759002Poricoic acid A
HY-N9527-01Poricoic acid BM
TBZ2852Poricoic acid B
TBW00284Poricoic acid AM
HY-N11656Poricoic acid H
TN4817Poricoic acid AE
583060Poricoic acid G
371846Poricoic acid A discontinued

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