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prop-2-enyl (E,5S,6S,7S,8R)-8-[tert-butyl(dimethyl)silyl]oxy-5-[(2S)-2-[2,2-dimethyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]oxy-4-methyl-pentanoyl]oxy-6-methyl-7-(4-methylphenyl)sulfonyloxy-8-phenyl-oct-2-enoate

prop-2-enyl (E,5S,6S,7S,8R)-8-[tert-butyl(dimethyl)silyl]oxy-5-[(2S)-2-[2,2-dimethyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]oxy-4-methyl-pentanoyl]oxy-6-methyl-7-(4-methylphenyl)sulfonyloxy-8-phenyl-oct-2-enoate

Systemtic Name:prop-2-enyl (E,5S,6S,7S,8R)-8-[tert-butyl(dimethyl)silyl]oxy-5-[(2S)-2-[2,2-dimethyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]oxy-4-methyl-pentanoyl]oxy-6-methyl-7-(4-methylphenyl)sulfonyloxy-8-phenyl-oct-2-enoate
Openeye Name:allyl (E,5S,6S,7S,8R)-5-[(2S)-2-[3-(tert-butoxycarbonylamino)-2,2-dimethyl-propanoyl]oxy-4-methyl-pentanoyl]oxy-8-[tert-butyl(dimethyl)silyl]oxy-6-methyl-8-phenyl-7-(p-tolylsulfonyloxy)oct-2-enoate
CAS Name:(E,5S,6S,7S,8R)-8-[tert-butyl(dimethyl)silyl]oxy-5-[(2S)-2-[2,2-dimethyl-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropoxy]-4-methyl-1-oxopentoxy]-6-methyl-7-(4-methylphenyl)sulfonyloxy-8-phenyl-2-octenoic acid prop-2-enyl ester
IUPAC Name:prop-2-enyl (E,5S,6S,7S,8R)-8-[tert-butyl(dimethyl)silyl]oxy-5-[(2S)-2-[2,2-dimethyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]oxy-4-methylpentanoyl]oxy-6-methyl-7-(4-methylphenyl)sulfonyloxy-8-phenyloct-2-enoate
Traditional Name:(E,5S,6S,7S,8R)-5-[(2S)-2-[3-(tert-butoxycarbonylamino)-2,2-dimethyl-propanoyl]oxy-4-methyl-pentanoyl]oxy-8-[tert-butyl(dimethyl)silyl]oxy-6-methyl-8-phenyl-7-tosyloxy-oct-2-enoic acid allyl ester
Formula: C47H71NO12SSi
MolecularWeight: 902.21664
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C(C)C(CC=CC(=O)OCC=C)OC(=O)C(CC(C)C)OC(=O)C(C)(C)CNC(=O)OC(C)(C)C)C(C2=CC=CC=C2)O[Si](C)(C)C(C)(C)C


Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@@H]([C@@H](C)[C@H](C/C=C/C(=O)OCC=C)OC(=O)[C@H](CC(C)C)OC(=O)C(C)(C)CNC(=O)OC(C)(C)C)[C@@H](C2=CC=CC=C2)O[Si](C)(C)C(C)(C)C


InChI

InChI=1S/C47H71NO12SSi/c1-16-29-55-39(49)24-20-23-37(56-42(50)38(30-32(2)3)57-43(51)47(12,13)31-48-44(52)58-45(6,7)8)34(5)40(59-61(53,54)36-27-25-33(4)26-28-36)41(35-21-18-17-19-22-35)60-62(14,15)46(9,10)11/h16-22,24-28,32,34,37-38,40-41H,1,23,29-31H2,2-15H3,(H,48,52)/b24-20+/t34-,37-,38-,40-,41+/m0/s1


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