Products for Research Use Only
RegisterLogin

Grindelic acid

CAT: 0013-GTR19228086-01Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19228086-01Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Grindelic acid (CAS 1438-57-9) is a small molecule for research use. It serves as a valuable tool compound in life science research, including studies in plant biology and phytochemistry for both in vitro and in vivo experimental applications.
CAS Number
1438-57-9
Smiles
CC1=CCC2C (C) (C) CCC[C@]2 (C) [C@@]11CC[C@] (C) (CC (O) =O) O1
Molecular Formula
C20H32O3
Molecular Weight
320.473
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Grindelic Acid

grindelic acid has been reported in Grindelia hirsutula, Grindelia boliviana, and other organisms with data available.

CAS Number1438-57-9
PubChem CID92885
IUPAC Name2-[(2'S,4aS,8R,8aS)-2',4,4,7,8a-pentamethylspiro[2,3,4a,5-tetrahydro-1H-naphthalene-8,5'-oxolane]-2'-yl]acetic acid
Molecular FormulaC20H32O3
Molecular Weight320.5
XLogP4.1
Topological Polar Surface Area46.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count23
Formal Charge0
Complexity549
SMILES
CC1=CC[C@@H]2[C@@]([C@@]13CC[C@@](O3)(C)CC(=O)O)(CCCC2(C)C)C
InChI
InChI=1S/C20H32O3/c1-14-7-8-15-17(2,3)9-6-10-19(15,5)20(14)12-11-18(4,23-20)13-16(21)22/h7,15H,6,8-13H2,1-5H3,(H,21,22)/t15-,18-,19-,20+/m0/s1
InChIKey
XLWWERNKTLITEF-MVJPYGJCSA-N
Chemical Structure
2D Structure
2D structure of Grindelic Acid
CAS: 1438-57-9
CID: 92885
Formula: C20H32O3
MW: 320.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight320.5
XLogP34.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass320.23514488
Monoisotopic Mass320.23514488
Topological Polar Surface Area46.5 Ų
Heavy Atom Count23
Formal Charge0
Complexity549
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19154372-01Koningic acid (Heptelidic acid)
GTR19350542-01Acid Red 186 free acid
GTR19215994-01Acid-PEG2-SS-PEG2-acid
GTR19226787-01Acid-PEG3-SS-PEG3-acid
GTR19226061-01Acid-PEG4-S-PEG4-acid
GTR19222080-01Acid-PEG8-S-S-PEG8-acid
GTR19150586Lignoceric acid-BSA (Fatty Acid Free)
GTR19150588Arachidic acid-BSA (Fatty Acid Free)
GTR19226785-01Acid-PEG4-S-S-PEG4-acid
GTR19150587Docosanoic acid-BSA (Fatty Acid Free)

Alternative Products

CatalogName
T125862-01Grindelic acid
BAA43857-01(-) -Grindelic acid
OR1071368-01Acid-apeg6-acid
MBS6083807-01Medronic Acid (Methylenebiphosphonic Acid, Methylenediphosphonic Acid, Methanebisphosphonic Acid, Methanediphosphonic Acid, MDP)
L2500-01Lipoic Acid (Thioctic Acid, (±) -α-Lipoic Acid)
041005Cacodylic Acid (dimethylarsonic acid, dimethylarsinic acid)
MBS641082-01Lipoic Acid (Thioctic Acid, Alpha Lipoic Acid)
O8099-01Oxalacetic Acid (Oxaloacetic acid)
275335-01Ethylenediaminediacetic acid dipropionic acid
MBS6036559-01a-Lipoic Acid (Thioctic Acid)

Popular Products