CAS 68567-60-2

2H-Pyran-2-acetic acid, tetrahydro-2-hydroxy-4-methoxy-6-[(1S)-1-[(2S,5R,7S,8R,9S)-9-methoxy-2,8-dimethyl-2-[(2S,2′R,3′S,4′R,5R,5′R)-octahydro-4′-methoxy-2,3′-dimethyl-5′-[(2S,3S,4S,5R,6S)-tetrahydro-6-hydroxy-4-methoxy-3,5,6-trimethyl-2H-pyran-2-yl][2,2′-bifuran]-5-yl]-1,6-dioxaspiro[4.5]dec-7-yl]ethyl]-α,3,5-trimethyl-, (αS,2S,3R,4S,5R,6S)-

Description:

2H-Pyran-2-acetic acid, tetrahydro-2-hydroxy-4-methoxy-6-[(1S)-1-[(2S,5R,7S,8R,9S)-9-methoxy-2,8-dimethyl-2-[(2S,2′R,3′S,4′R,5R,5′R)-octahydro-4′-methoxy-2,3′-dimethyl-5′-[(2S,3S,4S,5R,6S)-tetrahydro-6-hydroxy-4-methoxy-3,5,6-trimethyl-2H-pyran-2-yl][2,2′-bifuran]-5-yl]-1,6-dioxaspiro[4.5]dec-7-yl]ethyl]-α,3,5-trimethyl-, (αS,2S,3R,4S,5R,6S)- is a complex organic compound characterized by its intricate molecular structure, which includes multiple chiral centers and functional groups such as methoxy, hydroxy, and dioxaspiro moieties. This compound is likely to exhibit significant biological activity due to its structural complexity, potentially influencing various biochemical pathways. Its solubility, stability, and reactivity would depend on the specific functional groups present, as well as the stereochemistry of the molecule. The presence of multiple stereocenters suggests that it may exist in several stereoisomeric forms, which could lead to variations in its pharmacological properties. Overall, this compound represents a fascinating example of synthetic organic chemistry, with potential applications in pharmaceuticals or agrochemicals.

Formula: C₄₄H₇₆O₁₄

InChI: InChI=1S/C44H76O14/c1-21-29(49-12)20-43(56-31(21)22(2)32-23(3)34(51-14)27(7)44(48,57-32)28(8)39(45)46)19-18-40(9,58-43)30-16-17-41(10,54-30)38-25(5)35(52-15)37(53-38)36-24(4)33(50-13)26(6)42(11,47)55-36/h21-38,47-48H,16-20H2,1-15H3,(H,45,46)/t21-,22-,23+,24+,25+,26-,27-,28-,29+,30-,31+,32-,33+,34+,35-,36+,37-,38-,40+,41+,42+,43-,44+/m1/s1

InChI key: InChIKey=BKZOUCVNTCLNFF-SQGGLTFESA-N

SMILES: C[C@@]1(O[C@]2(O[C@]([C@@H](C)[C@]3(O[C@@]([C@@H](C(O)=O)C)(O)[C@H](C)[C@@H](OC)[C@H]3C)[H])([C@H](C)[C@@H](OC)C2)[H])CC1)[C@@]4(O[C@@](C)(CC4)[C@@]5(O[C@]([C@H](OC)[C@@H]5C)([C@@]6([C@@H](C)[C@H](OC)[C@@H](C)[C@@](C)(O)O6)[H])[H])[H])[H]

Synonyms:

• Lonomycin A, (3S)-
• 1,6-Dioxaspiro[4.5]decane, lonomycin A deriv.
• Lonomycin B
• 2H-Pyran-2-acetic acid, tetrahydro-2-hydroxy-4-methoxy-6-[(1S)-1-[(2S,5R,7S,8R,9S)-9-methoxy-2,8-dimethyl-2-[(2S,2′R,3′S,4′R,5R,5′R)-octahydro-4′-methoxy-2,3′-dimethyl-5′-[(2S,3S,4S,5R,6S)-tetrahydro-6-hydroxy-4-methoxy-3,5,6-trimethyl-2H-pyran-2-yl][2,2′-bifuran]-5-yl]-1,6-dioxaspiro[4.5]dec-7-yl]ethyl]-α,3,5-trimethyl-, (αS,2S,3R,4S,5R,6S)-
• 2H-Pyran-2-acetic acid, tetrahydro-2-hydroxy-4-methoxy-6-[1-[9-methoxy-2,8-dimethyl-2-[octahydro-4′-methoxy-2,3′-dimethyl-5′-(tetrahydro-6-hydroxy-4-methoxy-3,5,6-trimethyl-2H-pyran-2-yl)[2,2′-bifuran]-5-yl]-1,6-dioxaspiro[4.5]dec-7-yl]ethyl]-α,3,5-trimethyl-, [2S-[2α,2(R*),3β,4α,5α,6α[R*[2R*[2R*,2′S*,3′R*,4′S*,5S*,5′S*(2R*,3R*,4R*,5S*,6R*)],5S*,7R*,8S*,9R*]]]]-

Lonomycin B

CAS: 68567-60-2

Lonomycin B is the isomer of Lonomycin A.

Formula: C₄₄H₇₆O₁₄

Color and Shape: Solid

Molecular weight: 829.07

Ref: TM-T32865