Carnosol
Properties
- Molecular formula
- C20H26O4
- Molar mass
- 330.42 g/mol
- Exact mass
- 330.1831 Da
- Melting point
- 240–242 °C
- logP
- 4.29Crippen estimate
- Polar surface area
- 66.8 Ų
- H-bond donors / acceptors
- 2 / 4
- Rotatable bonds
- 1
- Stereocentres
- R, S, Sin SMILES atom order
Identifiers
CAS number
5957-80-2SMILES
CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1C[C@@H]2OC3=OInChIKey
XUSYGBPHQBWGAD-PJSUUKDQSA-NInChI
InChI=1S/C20H26O4/c1-10(2)11-8-12-13-9-14-19(3,4)6-5-7-20(14,18(23)24-13)15(12)17(22)16(11)21/h8,10,13-14,21-22H,5-7,9H2,1-4H3/t13-,14-,20+/m0/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
6 names
- 2H-9,4a-(Epoxymethano)phenanthren-12-one, 1,3,4,9,10,10a-hexahydro-5,6-dihydroxy-1,1-dimethyl-7-(1-methylethyl)-, (4aR,9S,10aS)-
- Picrosalvin
- Podocarpa-8,11,13-trien-17-oic acid, 7β,11,12-trihydroxy-13-isopropyl-, 17,7-lactone
- 2H-9,4a-(Epoxymethano)phenanthren-12-one, 1,3,4,9,10,10a-hexahydro-5,6-dihydroxy-1,1-dimethyl-7-(1-methylethyl)-, [4aR-(4aα,9α,10aβ)]-
- (4aR,9S,10aS)-1,3,4,9,10,10a-Hexahydro-5,6-dihydroxy-1,1-dimethyl-7-(1-methylethyl)-2H-9,4a-(epoxymethano)phenanthren-12-one
- NSC 39143
Work with Carnosol
Similar compounds
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds