Current position:Home >Product >

[(2S,3R,4R,5S,6R)-6-[[(2R,3S,4R,5R,6S)-3-[(2S,3R,4R,5S,6R)-4-acetyloxy-3-[1,3-bis(oxidanylidene)isoindol-2-yl]-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-[(2S,3R,4R,5S,6R)-4,5-diacetyloxy-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-[[(Z)-octadec-11-enoyl]amino]oxan-2-yl]oxy-oxan-2-yl]oxy-5-[1,3-bis(oxidanylidene)isoindol-2-yl]-6-[tert-butyl(dimethyl)silyl]oxy-4-oxidanyl-oxan-2-yl]methoxy]-5-methoxy-2-methyl-4-(phenylcarbonyloxy)oxan-3-yl] benzoate

Systemtic Name:	[(2S,3R,4R,5S,6R)-6-[[(2R,3S,4R,5R,6S)-3-[(2S,3R,4R,5S,6R)-4-acetyloxy-3-[1,3-bis(oxidanylidene)isoindol-2-yl]-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-[(2S,3R,4R,5S,6R)-4,5-diacetyloxy-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-[[(Z)-octadec-11-enoyl]amino]oxan-2-yl]oxy-oxan-2-yl]oxy-5-[1,3-bis(oxidanylidene)isoindol-2-yl]-6-[tert-butyl(dimethyl)silyl]oxy-4-oxidanyl-oxan-2-yl]methoxy]-5-methoxy-2-methyl-4-(phenylcarbonyloxy)oxan-3-yl] benzoate
Openeye Name:	[(2S,3R,4R,5S,6R)-6-[[(2R,3S,4R,5R,6S)-3-[(2S,3R,4R,5S,6R)-4-acetoxy-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-[(2S,3R,4R,5S,6R)-4,5-diacetoxy-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-[[(Z)-octadec-11-enoyl]amino]tetrahydropyran-2-yl]oxy-3-(1,3-dioxoisoindolin-2-yl)tetrahydropyran-2-yl]oxy-6-[tert-butyl(dimethyl)silyl]oxy-5-(1,3-dioxoisoindolin-2-yl)-4-hydroxy-tetrahydropyran-2-yl]methoxy]-4-benzoyloxy-5-methoxy-2-methyl-tetrahydropyran-3-yl] benzoate
CAS Name:	benzoic acid [(2S,3R,4R,5S,6R)-6-[[(2R,3S,4R,5R,6S)-3-[[(2S,3R,4R,5S,6R)-4-acetyloxy-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-[[(2S,3R,4R,5S,6R)-4,5-diacetyloxy-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-[[(Z)-1-oxooctadec-11-enyl]amino]-2-oxanyl]oxy]-3-(1,3-dioxo-2-isoindolyl)-2-oxanyl]oxy]-6-[tert-butyl(dimethyl)silyl]oxy-5-(1,3-dioxo-2-isoindolyl)-4-hydroxy-2-oxanyl]methoxy]-4-benzoyloxy-5-methoxy-2-methyl-3-oxanyl] ester
IUPAC Name:	[(2S,3R,4R,5S,6R)-6-[[(2R,3S,4R,5R,6S)-3-[(2S,3R,4R,5S,6R)-4-acetyloxy-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-[(2S,3R,4R,5S,6R)-4,5-diacetyloxy-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-[[(Z)-octadec-11-enoyl]amino]oxan-2-yl]oxy-3-(1,3-dioxoisoindol-2-yl)oxan-2-yl]oxy-6-[tert-butyl(dimethyl)silyl]oxy-5-(1,3-dioxoisoindol-2-yl)-4-hydroxyoxan-2-yl]methoxy]-4-benzoyloxy-5-methoxy-2-methyloxan-3-yl] benzoate
Traditional Name:	benzoic acid [(2S,3R,4R,5S,6R)-6-[[(2R,3S,4R,5R,6S)-3-[(2S,3R,4R,5S,6R)-4-acetoxy-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-[(2S,3R,4R,5S,6R)-4,5-diacetoxy-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-[[(Z)-octadec-11-enoyl]amino]tetrahydropyran-2-yl]oxy-3-phthalimido-tetrahydropyran-2-yl]oxy-6-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-5-phthalimido-tetrahydropyran-2-yl]methoxy]-4-benzoyloxy-5-methoxy-2-methyl-tetrahydropyran-3-yl] ester
Formula:	C₉₇H₁₃₉N₃O₂₇Si₃
MolecularWeight:	1863.40196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CCCCCCCCCCC(=O)NC1C(C(C(OC1OC2C(OC(C(C2OC(=O)C)N3C(=O)C4=CC=CC=C4C3=O)OC5C(OC(C(C5O)N6C(=O)C7=CC=CC=C7C6=O)O[Si](C)(C)C(C)(C)C)COC8C(C(C(C(O8)C)OC(=O)C9=CC=CC=C9)OC(=O)C1=CC=CC=C1)OC)CO[Si](C)(C)C(C)(C)C)CO[Si](C)(C)C(C)(C)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CCCCCC/C=C\CCCCCCCCCC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2OC(=O)C)N3C(=O)C4=CC=CC=C4C3=O)O[C@@H]5[C@H](O[C@H]([C@@H]([C@H]5O)N6C(=O)C7=CC=CC=C7C6=O)O[Si](C)(C)C(C)(C)C)CO[C@H]8[C@H]([C@@H]([C@@H]([C@@H](O8)C)OC(=O)C9=CC=CC=C9)OC(=O)C1=CC=CC=C1)OC)CO[Si](C)(C)C(C)(C)C)CO[Si](C)(C)C(C)(C)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C97H139N3O27Si3/c1-22-23-24-25-26-27-28-29-30-31-32-33-34-35-42-55-72(104)98-73-81(118-61(4)102)79(117-60(3)101)70(57-114-128(16,17)95(6,7)8)120-91(73)126-80-71(58-115-129(18,19)96(9,10)11)121-92(75(82(80)119-62(5)103)100-87(108)67-53-45-46-54-68(67)88(100)109)125-78-69(122-93(127-130(20,21)97(12,13)14)74(76(78)105)99-85(106)65-51-43-44-52-66(65)86(99)107)56-113-94-84(112-15)83(124-90(111)64-49-40-37-41-50-64)77(59(2)116-94)123-89(110)63-47-38-36-39-48-63/h27-28,36-41,43-54,59,69-71,73-84,91-94,105H,22-26,29-35,42,55-58H2,1-21H3,(H,98,104)/b28-27-/t59-,69+,70+,71+,73+,74+,75+,76+,77+,78+,79+,80+,81+,82+,83+,84-,91-,92-,93-,94+/m0/s1

Other Product