(E,2R,3S,4S,6R,10R,11R)-2,4,6,10-tetramethyl-3,7,11-tris(oxidanyl)tridec-8-enoic acid

Systemtic Name: (E,2R,3S,4S,6R,10R,11R)-2,4,6,10-tetramethyl-3,7,11-tris(oxidanyl)tridec-8-enoic acid Openeye Name: (E,2R,3S,4S,6R,10R,11R)-3,7,11-trihydroxy-2,4,6,10-tetramethyl-tridec-8-enoic acid CAS Name: (E,2R,3S,4S,6R,10R,11R)-3,7,11-trihydroxy-2,4,6,10-tetramethyl-8-tridecenoic acid IUPAC Name: (E,2R,3S,4S,6R,10R,11R)-3,7,11-trihydroxy-2,4,6,10-tetramethyltridec-8-enoic acid Traditional Name: (E,2R,3S,4S,6R,10R,11R)-3,7,11-trihydroxy-2,4,6,10-tetramethyl-tridec-8-enoic acid Formula: C17H32O5 MolecularWeight: 316.43298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H32O5/c1-6-14(18)10(2)7-8-15(19)11(3)9-12(4)16(20)13(5)17(21)22/h7-8,10-16,18-20H,6,9H2,1-5H3,(H,21,22)/b8-7+/t10-,11-,12+,13-,14-,15?,16+/m1/s1