Products 108885-61-6

CAS 108885-61-6 appears in our catalog under these names: Lupeol 3-hydroxyoctadecanoate, Lupeol β-hydroxyoctadecanoate. Offered by: Biosynth, MedChemExpress. Available pack sizes: 25mg, 10mg, 50mg, Get quote.

Lupeol 3-hydroxyoctadecanoate
Biosynth
  • size: 25mg, 10mg, 50mg
  • Variants: 3
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Lupeol β-hydroxyoctadecanoate
MedChemExpress
  • size: Get quote
  • Variants: 1
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Structural formula: {0} (CAS {1})

[(1R,3aR,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-yl] 3-hydroxyoctadecanoate (CAS 108885-61-6) is a chemical compound with the molecular formula C48H84O3 and a molecular weight of 709.2 g/mol. IUPAC name: [(1R,3aR,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-yl] 3-hydroxyoctadecanoate. InChIKey: ISCGWWWBTBITFA-HQBPQUAZSA-N.

Identity
Molecular formulaC48H84O3
Molecular weight709.2 g/mol
IUPAC name[(1R,3aR,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-yl] 3-hydroxyoctadecanoate
InChIKeyISCGWWWBTBITFA-HQBPQUAZSA-N
SMILESCCCCCCCCCCCCCCCC(CC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@@H]4[C@H]5[C@@H](CC[C@@]5(CC[C@]4([C@@]3(CC[C@H]2C1(C)C)C)C)C)C(=C)C)C)O

Computed by PubChem (NCBI)

Synonyms: Lupeol 3-hydroxyoctadecanoate, Lupeol |A-hydroxyoctadecanoate, Lupeol beta-hydroxyoctadecanoate, orb1682192