Retigeric acid A

cas: 35591-41-4 — see every product listed under this CAS number, including other names

Retigeric acid A (CAS 35591-41-4) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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cas35591-41-4
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Structural formula: {0} (CAS {1})

(3R,3aR,5aR,5bR,7aR,8S,9R,10R,11aS,13aS,13bR)-9,10-dihydroxy-3a,5a,8,11a,13a-pentamethyl-3-propan-2-yl-1,2,3,4,5,5b,6,7,7a,9,10,11,13,13b-tetradecahydrocyclopenta[a]chrysene-8-carboxylic acid (CAS 35591-41-4) is a chemical compound with the molecular formula C30H48O4 and a molecular weight of 472.7 g/mol. IUPAC name: (3R,3aR,5aR,5bR,7aR,8S,9R,10R,11aS,13aS,13bR)-9,10-dihydroxy-3a,5a,8,11a,13a-pentamethyl-3-propan-2-yl-1,2,3,4,5,5b,6,7,7a,9,10,11,13,13b-tetradecahydrocyclopenta[a]chrysene-8-carboxylic acid. InChIKey: CDJHWSUBFSVZDX-ORFZOPCBSA-N.

Identity
Molecular formulaC30H48O4
Molecular weight472.7 g/mol
IUPAC name(3R,3aR,5aR,5bR,7aR,8S,9R,10R,11aS,13aS,13bR)-9,10-dihydroxy-3a,5a,8,11a,13a-pentamethyl-3-propan-2-yl-1,2,3,4,5,5b,6,7,7a,9,10,11,13,13b-tetradecahydrocyclopenta[a]chrysene-8-carboxylic acid
InChIKeyCDJHWSUBFSVZDX-ORFZOPCBSA-N
SMILESCC(C)[C@H]1CC[C@@H]2[C@@]1(CC[C@]3([C@]2(CC=C4[C@@H]3CC[C@@H]5[C@@]4(C[C@H]([C@@H]([C@@]5(C)C(=O)O)O)O)C)C)C)C

Computed by PubChem (NCBI)

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