methyl (E,5R,6S,7R,8R,9S)-8-acetyloxy-5,7,9-trimethyl-6-oxidanyl-undec-3-enoate

Systemtic Name: methyl (E,5R,6S,7R,8R,9S)-8-acetyloxy-5,7,9-trimethyl-6-oxidanyl-undec-3-enoate Openeye Name: methyl (E,5R,6S,7R,8R,9S)-8-acetoxy-6-hydroxy-5,7,9-trimethyl-undec-3-enoate CAS Name: (E,5R,6S,7R,8R,9S)-8-acetyloxy-6-hydroxy-5,7,9-trimethyl-3-undecenoic acid methyl ester IUPAC Name: methyl (E,5R,6S,7R,8R,9S)-8-acetyloxy-6-hydroxy-5,7,9-trimethylundec-3-enoate Traditional Name: (E,5R,6S,7R,8R,9S)-8-acetoxy-6-hydroxy-5,7,9-trimethyl-undec-3-enoic acid methyl ester Formula: C17H30O5 MolecularWeight: 314.4171

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(C)C(C(C)C=CCC(=O)OC)O)OC(=O)C

Isomeric SMILES

CC[C@H](C)[C@H]([C@H](C)[C@H]([C@H](C)/C=C/CC(=O)OC)O)OC(=O)C

InChI

InChI=1S/C17H30O5/c1-7-11(2)17(22-14(5)18)13(4)16(20)12(3)9-8-10-15(19)21-6/h8-9,11-13,16-17,20H,7,10H2,1-6H3/b9-8+/t11-,12+,13+,16-,17+/m0/s1