chempirical

Corosolic acid

C30H48O4CAS 4547-24-4472.71 g/mol

Open in Covalent MOL file
OHOOHOH
AlcoholAlkeneCarboxylic acid

Properties

Molecular formula
C30H48O4
Molar mass
472.71 g/mol
Exact mass
472.3553 Da
Melting point
283–285 °C
logP
6.06Crippen estimate
Polar surface area
77.8 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
1
Stereocentres
S, R, S, S, R, R, R, R, R, R, Sin SMILES atom order

Identifiers

CAS number
4547-24-4
SMILES
C[C@H]1[C@H](C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@H]12
InChIKey
HFGSQOYIOKBQOW-ZSDYHTTISA-N
InChI
InChI=1S/C30H48O4/c1-17-10-13-30(25(33)34)15-14-28(6)19(23(30)18(17)2)8-9-22-27(5)16-20(31)24(32)26(3,4)21(27)11-12-29(22,28)7/h8,17-18,20-24,31-32H,9-16H2,1-7H3,(H,33,34)/t17-,18+,20-,21+,22-,23+,24+,27+,28-,29-,30+/m1/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

13 names · show all
  • Urs-12-en-28-oic acid, 2,3-dihydroxy-, (2α,3β)-
  • Urs-12-en-28-oic acid, 2α,3β-dihydroxy-
  • (2α,3β)-2,3-Dihydroxyurs-12-en-28-oic acid
  • 2α-Hydroxyursolic acid
  • 2α,3β-Dihydroxyurs-12-en-28-oic acid
  • Corsolic acid
  • Glucosol
  • Colosic acid
  • Colosolic acid
  • 2α,3β-Dihydroxy ursolic acid
  • 2Alpha-Hydroxyursolic acid
  • 2α,2β,-Dihydroxy-12-en-28-ursolic acid
  • 2α,3β-Dihydroxylursolic acid

Work with Corosolic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Asiatic acid464-92-684 % similar Ursolic acid77-52-176 % similar Madecassic acid18449-41-775 % similar Euscaphic acid53155-25-269 % similar 3-O-Acetylursolic acid7372-30-768 % similar Ursonic acid6246-46-467 % similar Arjunolic acid465-00-958 % similar Beta-boswellic acid631-69-656 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Alisol G155521-46-3 Maslinic acid4373-41-5 Hederagenin465-99-6 Echinocystic acid510-30-5

Elsewhere

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