methyl (2S)-2-[[(2S)-2-[[(2R)-2-[(3aR,4R,6R,6aR)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoate

Systemtic Name: methyl (2S)-2-[[(2S)-2-[[(2R)-2-[(3aR,4R,6R,6aR)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[[(2S)-2-[[(2R)-2-[(3aR,4R,6R,6aR)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]-2-(tert-butoxycarbonylamino)acetyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(2S)-2-[[(2R)-2-[(3aR,4R,6R,6aR)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoethyl]amino]-4-methyl-1-oxopentyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2S)-2-[[(2R)-2-[(3aR,4R,6R,6aR)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[(2S)-2-[[(2R)-2-[(3aR,4R,6R,6aR)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]-2-(tert-butoxycarbonylamino)acetyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C28H49N3O10 MolecularWeight: 587.70276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC(C)C)C(=O)OC)NC(=O)C(C1C2C(C(O1)OC)OC(O2)(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)OC)NC(=O)[C@@H]([C@@H]1[C@@H]2[C@H]([C@@H](O1)OC)OC(O2)(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C28H49N3O10/c1-14(2)12-16(22(32)30-17(13-15(3)4)24(34)36-10)29-23(33)18(31-26(35)41-27(5,6)7)19-20-21(25(37-11)38-19)40-28(8,9)39-20/h14-21,25H,12-13H2,1-11H3,(H,29,33)(H,30,32)(H,31,35)/t16-,17-,18+,19+,20+,21+,25+/m0/s1