(1R,2R,3S,3aR,3a1S,4R,6aR,7aS,11S,11aS,11bR)-1,2,3a,4,11-Pentahydroxy-3,3a1,8,11a-tetramethyl-1,2,3,3a,3a1,4,6a,7,7a,11,11a,11b-dodecahydrodibenzo[de,g]chromene-5,10-dione

cas: 137359-82-1 — see every product listed under this CAS number, including other names

(1R,2R,3S,3aR,3a1S,4R,6aR,7aS,11S,11aS,11bR)-1,2,3a,4,11-Pentahydroxy-3,3a1,8,11a-tetramethyl-1,2,3,3a,3a1,4,6a,7,7a,11,11a,11b-dodecahydrodibenzo[de,g]chromene-5,10-dione (CAS 137359-82-1) is a chemical reagent available from Chemat. Available pack sizes: 1mg, 10mg. Offered by: Chemat.

• 2D
• 3D

(1R,2S,3S,7S,9R,12R,13R,14S,15R,16R,17S)-3,12,13,15,16-pentahydroxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-5-ene-4,11-dione (CAS 137359-82-1) is a chemical compound with the molecular formula C20H28O8 and a molecular weight of 396.4 g/mol. IUPAC name: (1R,2S,3S,7S,9R,12R,13R,14S,15R,16R,17S)-3,12,13,15,16-pentahydroxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-5-ene-4,11-dione. InChIKey: NWNMAVFXIRDAPM-RELKVJPISA-N.

Identity

Molecular formula	C20H28O8
Molecular weight	396.4 g/mol
IUPAC name	(1R,2S,3S,7S,9R,12R,13R,14S,15R,16R,17S)-3,12,13,15,16-pentahydroxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-5-ene-4,11-dione
InChIKey	NWNMAVFXIRDAPM-RELKVJPISA-N
SMILES	C[C@H]1[C@H]([C@@H]([C@@H]2[C@@]3([C@@H](C[C@@H]4[C@]2([C@]1([C@H](C(=O)O4)O)O)C)C(=CC(=O)[C@H]3O)C)C)O)O

Computed by PubChem (NCBI)

Synonyms: 14,15beta-dihydroxyklaineanone, 14,15-beta-dihydroxyklaineanone, 14,15 |A-Dihydroxyklaineanone, orb1684905, 14,15 |?-Dihydroxyklaineanone

Isomers (same molecular formula)

(2R,3R,4S,5S,6R)-2-[(4E,12E)-1,7-dihydroxytetradeca-4,12-dien-8,10-diyn-6-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol C₂₀H₂₈O₈

2,3-dihydroxypropyl 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhexanoate C₂₀H₂₈O₈

(2S,3S)-3-hydroxy-2,5,7-trimethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-2,3-dihydroinden-1-one C₂₀H₂₈O₈

(2R,3R,4S,5S,6R)-2-[(4E,6R,7R,12E)-1,7-dihydroxytetradeca-4,12-dien-8,10-diyn-6-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol C₂₀H₂₈O₈

(2S,3S)-6-(2-hydroxyethyl)-2,5,7-trimethyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydroinden-1-one C₂₀H₂₈O₈

(2S,3R)-3-hydroxy-2,5,7-trimethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-2,3-dihydroinden-1-one C₂₀H₂₈O₈