Dehydrotumulosic acid (Standard)

cas: 6754-16-1 — see every product listed under this CAS number, including other names

Dehydrotumulosic acid (Standard) (CAS 6754-16-1) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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cas6754-16-1
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Structural formula: {0} (CAS {1})

(2R)-2-[(3S,5R,10S,13R,14R,16R,17R)-3,16-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methyl-5-methylideneheptanoic acid (CAS 6754-16-1) is a chemical compound with the molecular formula C31H48O4 and a molecular weight of 484.7 g/mol. IUPAC name: (2R)-2-[(3S,5R,10S,13R,14R,16R,17R)-3,16-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methyl-5-methylideneheptanoic acid. InChIKey: LADJWZMBZBVBSB-YEXRKOARSA-N.

Identity
Molecular formulaC31H48O4
Molecular weight484.7 g/mol
IUPAC name(2R)-2-[(3S,5R,10S,13R,14R,16R,17R)-3,16-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methyl-5-methylideneheptanoic acid
InChIKeyLADJWZMBZBVBSB-YEXRKOARSA-N
SMILESCC(C)C(=C)CC[C@H]([C@H]1[C@@H](C[C@@]2([C@@]1(CC=C3C2=CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O)C)C)C)O)C(=O)O

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