methyl (E,6S,7S,10S)-3,7,11-trimethyl-6,7,10,11-tetrakis(oxidanyl)dodec-2-enoate

Systemtic Name: methyl (E,6S,7S,10S)-3,7,11-trimethyl-6,7,10,11-tetrakis(oxidanyl)dodec-2-enoate Openeye Name: methyl (E,6S,7S,10S)-6,7,10,11-tetrahydroxy-3,7,11-trimethyl-dodec-2-enoate CAS Name: (E,6S,7S,10S)-6,7,10,11-tetrahydroxy-3,7,11-trimethyl-2-dodecenoic acid methyl ester IUPAC Name: methyl (E,6S,7S,10S)-6,7,10,11-tetrahydroxy-3,7,11-trimethyldodec-2-enoate Traditional Name: (E,6S,7S,10S)-6,7,10,11-tetrahydroxy-3,7,11-trimethyl-dodec-2-enoic acid methyl ester Formula: C16H30O6 MolecularWeight: 318.4058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H30O6/c1-11(10-14(19)22-5)6-7-13(18)16(4,21)9-8-12(17)15(2,3)20/h10,12-13,17-18,20-21H,6-9H2,1-5H3/b11-10+/t12-,13-,16-/m0/s1