(E)-5-[(1R,2R,5R,8aS)-5-(acetyloxymethyl)-2,5,8a-trimethyl-2-oxidanyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methyl-pent-2-enoic acid

Systemtic Name: (E)-5-[(1R,2R,5R,8aS)-5-(acetyloxymethyl)-2,5,8a-trimethyl-2-oxidanyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methyl-pent-2-enoic acid Openeye Name: (E)-5-[(1R,2R,5R,8aS)-5-(acetoxymethyl)-2-hydroxy-2,5,8a-trimethyl-decalin-1-yl]-3-methyl-pent-2-enoic acid CAS Name: (E)-5-[(1R,2R,5R,8aS)-5-(acetyloxymethyl)-2-hydroxy-2,5,8a-trimethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methyl-2-pentenoic acid IUPAC Name: (E)-5-[(1R,2R,5R,8aS)-5-(acetyloxymethyl)-2-hydroxy-2,5,8a-trimethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-enoic acid Traditional Name: (E)-5-[(1R,2R,5R,8aS)-5-(acetoxymethyl)-2-hydroxy-2,5,8a-trimethyl-decalin-1-yl]-3-methyl-pent-2-enoic acid Formula: C22H36O5 MolecularWeight: 380.51824

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)O)CCC1C2(CCCC(C2CCC1(C)O)(C)COC(=O)C)C

Isomeric SMILES

C/C(=C\C(=O)O)/CC[C@@H]1[C@]2(CCC[C@@](C2CC[C@@]1(C)O)(C)COC(=O)C)C

InChI

InChI=1S/C22H36O5/c1-15(13-19(24)25)7-8-18-21(4)11-6-10-20(3,14-27-16(2)23)17(21)9-12-22(18,5)26/h13,17-18,26H,6-12,14H2,1-5H3,(H,24,25)/b15-13+/t17?,18-,20+,21+,22-/m1/s1