3beta-Hydroxy-18alpha-18,29-epoxyolean-12-ene-11,29-dione
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Identifiers
CAS number
10376-64-4Molecular formula
C30H44O4SMILES
C[C@]12CC[C@@]3(C[C@@]1(C4=CC(=O)[C@@H]5[C@]6(CC[C@@H](C([C@@H]6CC[C@]5([C@@]4(CC2)C)C)(C)C)O)C)OC3=O)C
Safety labels
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Odor profile
Fragrance Woody 80.02% Cedar 51.35% Amber 50.28% Dry 45.46% Musk 38.16% Tobacco 37.22% Camphoreous 36.68% Spicy 34.81% Earthy 34.38% Vetiver 31.0% Flavor Bitter 62.52% Woody 46.72% Camphor 46.26% Pine 33.75% Herbal 30.11% Minty 26.83% Earthy 25.35% Spicy 25.0% Ripe apricot 24.79% Earth 24.51% Odor impact est.
Low -
Properties
XLogP3-AA
5.8pKa est.
6.54 (neutral)Molecular weight
468.7 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
Ultra fastBoiling point est.
154°CFlash point
- 240.16 ˚C est.
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Synonyms
- DTXSID001148116
- 10376-64-4
- 3beta-Hydroxy-18alpha-18,29-epoxyolean-12-ene-11,29-dione
- Olean-12-en-29-oic acid, 3,18-dihydroxy-11-oxo-, I(3)-lactone, (3I(2),18I+/-,20I+/-)-
- 10376-64-4
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Applications
3beta-Hydroxy-18alpha-18,29-epoxyolean-12-ene-11,29-dione (CAS 10376-64-4) is a steroid-like oleanane derivative commonly used as an intermediate or building block in the synthesis of steroidal compounds and other triterpenoid derivatives. Practical applications include: serving as an intermediate for pharmaceutical and steroid synthesis; acting as a scaffold for medicinal chemistry studies and structure-activity relationship (SAR) exploration; used as an intermediate in cosmetics/personal care to develop steroid-related active ingredients or derivatives; employed as a building block in industrial synthesis of functionalized oleanane compounds; and may be evaluated in agricultural research or plant-derived bioactive compounds in early development.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 24.05 methanol 13.04 isopropanol 27.8 water 0.02 ethyl acetate 33.3 n-propanol 44.2 acetone 33.86 n-butanol 42.29 acetonitrile 18.94 DMF 153.67 toluene 44.58 isobutanol 30.12 1,4-dioxane 88.26 methyl acetate 27.15 THF 167.35 2-butanone 47.41 n-pentanol 28.71 sec-butanol 20.52 n-hexane 1.22 ethylene glycol 3.34 NMP 136.16 cyclohexane 2.16 DMSO 45.44 n-butyl acetate 25.99 n-octanol 10.6 chloroform 93.77 n-propyl acetate 21.41 acetic acid 26.15 dichloromethane 49.68 cyclohexanone 80.6 propylene glycol 7.4 isopropyl acetate 30.13 DMAc 117.45 2-ethoxyethanol 43.22 isopentanol 27.83 n-heptane 0.86 ethyl formate 17.63 1,2-dichloroethane 32.28 n-hexanol 31.78 2-methoxyethanol 66.28 isobutyl acetate 20.26 tetrachloromethane 13.36 n-pentyl acetate 28.95 transcutol 58.38 n-heptanol 18.59 ethylbenzene 16.31 MIBK 30.87 2-propoxyethanol 96.78 tert-butanol 16.84 MTBE 16.47 2-butoxyethanol 50.61 propionic acid 23.82 o-xylene 19.43 formic acid 9.24 diethyl ether 32.17 m-xylene 23.82 p-xylene 18.46 chlorobenzene 39.88 dimethyl carbonate 30.74 n-octane 0.33 formamide 16.0 cyclopentanone 109.36 2-pentanone 45.48 anisole 35.08 cyclopentyl methyl ether 56.9 gamma-butyrolactone 95.76 1-methoxy-2-propanol 73.37 pyridine 91.36 3-pentanone 39.05 furfural 74.67 n-dodecane 0.25 diethylene glycol 41.4 diisopropyl ether 8.56 tert-amyl alcohol 13.28 acetylacetone 44.97 n-hexadecane 0.32 acetophenone 35.68 methyl propionate 43.11 isopentyl acetate 29.83 trichloroethylene 77.26 n-nonanol 12.73 cyclohexanol 26.91 benzyl alcohol 36.03 2-ethylhexanol 14.64 isooctanol 14.74 dipropyl ether 16.74 1,2-dichlorobenzene 34.27 ethyl lactate 18.02 propylene carbonate 41.67 n-methylformamide 45.68 2-pentanol 20.82 n-pentane 1.53 1-propoxy-2-propanol 53.88 1-methoxy-2-propyl acetate 50.71 2-(2-methoxypropoxy) propanol 32.15 mesitylene 11.33 ε-caprolactone 68.57 p-cymene 8.46 epichlorohydrin 104.62 1,1,1-trichloroethane 33.44 2-aminoethanol 13.74 morpholine-4-carbaldehyde 157.54 sulfolane 95.72 2,2,4-trimethylpentane 0.85 2-methyltetrahydrofuran 62.69 n-hexyl acetate 30.51 isooctane 0.77 2-(2-butoxyethoxy)ethanol 42.57 sec-butyl acetate 18.27 tert-butyl acetate 28.41 decalin 1.54 glycerin 15.03 diglyme 72.32 acrylic acid 22.95 isopropyl myristate 10.92 n-butyric acid 43.23 acetyl acetate 24.44 di(2-ethylhexyl) phthalate 17.38 ethyl propionate 23.7 nitromethane 47.21 1,2-diethoxyethane 23.56 benzonitrile 35.74 trioctyl phosphate 12.02 1-bromopropane 24.37 gamma-valerolactone 166.03 n-decanol 7.38 triethyl phosphate 13.89 4-methyl-2-pentanol 13.47 propionitrile 33.13 vinylene carbonate 47.9 1,1,2-trichlorotrifluoroethane 61.22 DMS 29.51 cumene 9.54 2-octanol 9.12 2-hexanone 27.55 octyl acetate 14.91 limonene 9.32 1,2-dimethoxyethane 60.95 ethyl orthosilicate 14.24 tributyl phosphate 11.36 diacetone alcohol 32.79 N,N-dimethylaniline 25.17 acrylonitrile 39.79 aniline 46.68 1,3-propanediol 30.51 bromobenzene 39.18 dibromomethane 35.33 1,1,2,2-tetrachloroethane 63.52 2-methyl-cyclohexyl acetate 24.35 tetrabutyl urea 17.86 diisobutyl methanol 7.55 2-phenylethanol 44.38 styrene 19.04 dioctyl adipate 19.06 dimethyl sulfate 40.94 ethyl butyrate 20.78 methyl lactate 30.14 butyl lactate 27.23 diethyl carbonate 13.88 propanediol butyl ether 30.44 triethyl orthoformate 20.18 p-tert-butyltoluene 8.26 methyl 4-tert-butylbenzoate 38.24 morpholine 126.73 tert-butylamine 8.92 n-dodecanol 4.36 dimethoxymethane 96.94 ethylene carbonate 38.9 cyrene 48.87 2-ethoxyethyl acetate 42.15 2-ethylhexyl acetate 24.06 1,2,4-trichlorobenzene 46.76 4-methylpyridine 83.85 dibutyl ether 7.83 2,6-dimethyl-4-heptanol 7.55 DEF 56.91 dimethyl isosorbide 61.05 tetrachloroethylene 40.47 eugenol 41.52 triacetin 31.36 span 80 29.9 1,4-butanediol 11.71 1,1-dichloroethane 32.76 2-methyl-1-pentanol 19.99 methyl formate 25.93 2-methyl-1-butanol 25.81 n-decane 0.62 butyronitrile 32.23 3,7-dimethyl-1-octanol 9.84 1-chlorooctane 4.51 1-chlorotetradecane 1.36 n-nonane 0.45 undecane 0.37 tert-butylcyclohexane 1.28 cyclooctane 0.88 cyclopentanol 33.92 tetrahydropyran 75.5 tert-amyl methyl ether 13.99 2,5,8-trioxanonane 44.19 1-hexene 6.81 2-isopropoxyethanol 30.51 2,2,2-trifluoroethanol 12.64 methyl butyrate 27.15 Scent© AI
| Maximum acceptable concentrations in the finished product (%) | |||
|---|---|---|---|
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Category 1
Products applied to the lips
|
No restriction |
Category 7A
Rinse-off products applied to the hair with some hand contact
|
No restriction |
|
Category 2
Products applied to the axillae
|
No restriction |
Category 7B
Leave-on products applied to the hair with some hand contact
|
No restriction |
|
Category 3
Products applied to the face/body using fingertips
|
No restriction |
Category 8
Products with significant anogenital exposure
|
No restriction |
|
Category 4
Products related to fine fragrance
|
No restriction |
Category 9
Products with body and hand exposure, primarily rinse off
|
No restriction |
|
Category 5A
Body lotion products applied to the body using the hands (palms), primarily leave on
|
No restriction |
Category 10A
Household care products with mostly hand contact
|
No restriction |
|
Category 5B
Face moisturizer products applied to the face using the hands (palms), primarily leave on
|
No restriction |
Category 10B
Household care products with mostly hand contact, including aerosol/spray products (with potential leave-on skin contact)
|
No restriction |
|
Category 5C
Hand cream products applied to the hands using the hands (palms), primarily leave on
|
No restriction |
Category 11A
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure
|
No restriction |
|
Category 5D
Baby Creams, baby Oils and baby talc
|
No restriction |
Category 11B
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
|
No restriction |
|
Category 6
Products with oral and lip exposure
|
No restriction |
Category 12
Products not intended for direct skin contact, minimal or insignificant transfer to skin
|
No restriction |