CAS: 142561-96-4 - (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetoxy-5-methyl-3-methylene-6-phenyl-hexyl]-6-[(E,4S,6S)-4,6-dimethyloct-2-enoyl]oxy-4,7-dihydroxy-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid

Formula: C₃₅H₄₆O₁₄

InChI: InChI=1S/C35H46O14/c1-7-19(2)17-20(3)13-14-25(37)47-28-27(38)33(48-29(30(39)40)34(45,31(41)42)35(28,49-33)32(43)44)16-15-21(4)26(46-23(6)36)22(5)18-24-11-9-8-10-12-24/h8-14,19-20,22,26-29,38,45H,4,7,15-18H2,1-3,5-6H3,(H,39,40)(H,41,42)(H,43,44)/b14-13+/t19-,20+,22+,26+,27+,28+,29+,33-,34+,35-/m0/s1

InChI key: InChIKey=DFKDOZMCHOGOBR-NCSQYGPNSA-N

SMILES: O=C(OC1C(O)C2(OC(C(=O)O)C(O)(C(=O)O)C1(O2)C(=O)O)CCC(=C)C(OC(=O)C)C(C)CC=3C=CC=CC3)C=CC(C)CC(C)CC

Synonyms:

• (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-(acetyloxy)-5-methyl-3-methylidene-6-phenylhexyl]-6-{[(2E,4S,6S)-4,6-dimethyloct-2-enoyl]oxy}-4,7-dihydroxy-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid (non-preferred name)
• (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-Acetoxy-5-methyl-3-methylene-6-phenylhexyl]-6-{[(2E,4S,6S)-4,6-dimethyloct-2-enoyl]oxy}-4,7-dihydroxy-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid (non-preferred name)
• 142561-96-4
• 2,8-Dioxabicyclo[3.2.1]octane, <span class="text-smallcaps">L</smallcap>-erythro-<smallcap>L</smallcap>-glycero-<smallcap>D</span>-altro-7-trideculo-7,4-furanosonic acid deriv.
• <span class="text-smallcaps">L</smallcap>-erythro-<smallcap>L</smallcap>-glycero-<smallcap>D</span>-altro-7-Trideculo-7,4-furanosonic acid, 2,7-anhydro-3,4-di-C-carboxy-8,9,10,12,13-pentadeoxy-10-methylene-12-(phenylmethyl)-, 11-acetate 5-(4,6-dimethyl-2-octenoate), [5(2E,4S,6S),7S]-
• <span class="text-smallcaps">L</smallcap>-erythro-<smallcap>L</smallcap>-glycero-<smallcap>D</span>-altro-7-Trideculo-7,4-furanosonic acid, 2,7-anhydro-3,4-di-C-carboxy-8,9,10,12,13-pentadeoxy-10-methylene-12-(phenylmethyl)-, 11-acetate 5-[(2E,4S,6S)-4,6-dimethyl-2-octenoate], (7S)-
• Gr 105155X
• L 694599
• Squalestatin
• Squalestatin 1
• Squalestatin S₁
• Zaragozic acid A

ZARAGOZIC ACID A

CAS: 142561-96-4

• Formula: C₃₅H₄₆O₁₄
• Purity: 98%
• Molecular weight: 690.7313

Zaragozic Acid A

CAS: 142561-96-4

• Formula: C₃₅H₄₆O₁₄
• Molecular weight: 690.74