[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[[(1S,2R,5S)-2-acetyloxy-5-ethanoylsulfanyl-cyclopent-3-en-1-yl]amino]oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[[(1S,2R,5S)-2-acetyloxy-5-ethanoylsulfanyl-cyclopent-3-en-1-yl]amino]oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3R,4S,5R,6R)-3,4,5-triacetoxy-6-[[(1S,2R,5S)-2-acetoxy-5-acetylsulfanyl-cyclopent-3-en-1-yl]amino]tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[[(1S,2R,5S)-2-acetyloxy-5-(acetylthio)-1-cyclopent-3-enyl]amino]-2-oxanyl]methyl ester IUPAC Name: [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[[(1S,2R,5S)-2-acetyloxy-5-acetylsulfanylcyclopent-3-en-1-yl]amino]oxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3R,4S,5R,6R)-3,4,5-triacetoxy-6-[[(1S,2R,5S)-2-acetoxy-5-(acetylthio)cyclopent-3-en-1-yl]amino]tetrahydropyran-2-yl]methyl ester Formula: C23H31NO12S MolecularWeight: 545.55674

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)NC2C(C=CC2SC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)N[C@H]2[C@@H](C=C[C@@H]2SC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C23H31NO12S/c1-10(25)31-9-17-20(33-12(3)27)21(34-13(4)28)22(35-14(5)29)23(36-17)24-19-16(32-11(2)26)7-8-18(19)37-15(6)30/h7-8,16-24H,9H2,1-6H3/t16-,17-,18+,19+,20-,21+,22-,23-/m1/s1