Carnosic acid
Properties
- Molecular formula
- C20H28O4
- Molar mass
- 332.44 g/mol
- Exact mass
- 332.1988 Da
- Melting point
- 201–202 °C
- logP
- 4.32Crippen estimate
- Polar surface area
- 77.8 Ų
- H-bond donors / acceptors
- 3 / 3
- Rotatable bonds
- 2
- Stereocentres
- R, Sin SMILES atom order
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library
Identifiers
CAS number
3650-09-7SMILES
CC(C)c1cc2c(c(O)c1O)[C@@]1(C(=O)O)CCCC(C)(C)[C@@H]1CC2InChIKey
QRYRORQUOLYVBU-VBKZILBWSA-NInChI
InChI=1S/C20H28O4/c1-11(2)13-10-12-6-7-14-19(3,4)8-5-9-20(14,18(23)24)15(12)17(22)16(13)21/h10-11,14,21-22H,5-9H2,1-4H3,(H,23,24)/t14-,20+/m0/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
9 names
- 4a(2H)-Phenanthrenecarboxylic acid, 1,3,4,9,10,10a-hexahydro-5,6-dihydroxy-1,1-dimethyl-7-(1-methylethyl)-, (4aR,10aS)-
- Podocarpa-8,11,13-trien-17-oic acid, 11,12-dihydroxy-13-isopropyl-
- 4a(2H)-Phenanthrenecarboxylic acid, 1,3,4,9,10,10a-hexahydro-5,6-dihydroxy-1,1-dimethyl-7-(1-methylethyl)-, (4aR-trans)-
- (4aR,10aS)-1,3,4,9,10,10a-Hexahydro-5,6-dihydroxy-1,1-dimethyl-7-(1-methylethyl)-4a(2H)-phenanthrenecarboxylic acid
- Salvin
- RoseOx
- Rosamox
- (+)-Carnosic acid
- (4AR,10aS)-5,6-dihydroxy-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid
Work with Carnosic acid
Similar compounds
Carnosol5957-80-256 % similar
Ecabet sodium86408-72-241 % similar
Dehydroabietic acid1740-19-841 % similar
3,5-Diisopropylsalicylic acid2215-21-631 % similar
1-Methylcyclobutanecarboxylic acid32936-76-830 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds