Products for Research Use Only
RegisterLogin

Ursolic acid 1g

CAT: 0628-A10961-1000Size: 1000 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0628-A10961-1000Size:1000 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
77-52-1

Chemical Information

(+)-Ursolic Acid

Ursolic acid is a pentacyclic triterpenoid that is urs-12-en-28-oic acid substituted by a beta-hydroxy group at position 3. It has a role as a geroprotector and a plant metabolite. It is a pentacyclic triterpenoid and a hydroxy monocarboxylic acid. It is a conjugate acid of an ursolate. It derives from a hydride of an ursane.

CAS Number77-52-1
PubChem CID64945
IUPAC Name(1S,2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid
Molecular FormulaC30H48O3
Molecular Weight456.7
XLogP7.3
Topological Polar Surface Area57.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count33
Formal Charge0
Complexity874
SMILES
C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]2[C@H]1C)C)C(=O)O
InChI
InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21+,22-,23+,24+,27+,28-,29-,30+/m1/s1
InChIKey
WCGUUGGRBIKTOS-GPOJBZKASA-N
Chemical Structure
2D Structure
2D structure of (+)-Ursolic Acid
CAS: 77-52-1
CID: 64945
Formula: C30H48O3
MW: 456.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight456.7
XLogP37.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass456.36034539
Monoisotopic Mass456.36034539
Topological Polar Surface Area57.5 Ų
Heavy Atom Count33
Formal Charge0
Complexity874
Isotope Atom Count0
Defined Atom Stereocenter Count10
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
A10961-200Ursolic acid 200mg
A10961-50Ursolic acid (Malol) 50mg
A10961-100Ursolic acid (Malol) 100mg
A18997-1000Urocanic acid 1g
A16157-1000Acetohydroxamic acid 1g
A18614-1000Citraconic acid 1g
A18295-1000Arsonic acid 1g
A17828-1000Phthalic acid 1g
A18970-1000Elaidic acid 1g
A16350-1000Lauric Acid 1g

Alternative Products

CatalogName
HY-N0140-01Ursolic acid

Popular Products