(R)-1-((2S,4aR,4bS,6S,8R,8aS)-6-Hydroxy-8-(hydroxymethyl)-2,4b,8-trimethyl-2,3,4,4a,4b,5,6,7,8,8a,9,10-dodecahydrophenanthren-2-yl)ethane-1,2-diol, 98%

cas: 52659-56-0 — see every product listed under this CAS number, including other names

(R)-1-((2S,4aR,4bS,6S,8R,8aS)-6-Hydroxy-8-(hydroxymethyl)-2,4b,8-trimethyl-2,3,4,4a,4b,5,6,7,8,8a,9,10-dodecahydrophenanthren-2-yl)ethane-1,2-diol, 98% (CAS 52659-56-0) is a chemical reagent available from Chemat. Available pack sizes: 25mg, 50mg, 100mg, 250mg, 1g, 1mg, 5mg. Offered by: BLDpharm, Chemat.

• 2D
• 3D

(1R)-1-[(2S,4aR,4bS,6S,8R,8aS)-6-hydroxy-8-(hydroxymethyl)-2,4b,8-trimethyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-2-yl]ethane-1,2-diol (CAS 52659-56-0) is a chemical compound with the molecular formula C20H34O4 and a molecular weight of 338.5 g/mol. IUPAC name: (1R)-1-[(2S,4aR,4bS,6S,8R,8aS)-6-hydroxy-8-(hydroxymethyl)-2,4b,8-trimethyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-2-yl]ethane-1,2-diol. InChIKey: NRYNTARIOIRWAB-JPDRSCFKSA-N.

Identity

Molecular formula	C20H34O4
Molecular weight	338.5 g/mol
IUPAC name	(1R)-1-[(2S,4aR,4bS,6S,8R,8aS)-6-hydroxy-8-(hydroxymethyl)-2,4b,8-trimethyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-2-yl]ethane-1,2-diol
InChIKey	NRYNTARIOIRWAB-JPDRSCFKSA-N
SMILES	C[C@@]1(CC[C@@H]2C(=C1)CC[C@H]3[C@]2(C[C@@H](C[C@@]3(C)CO)O)C)[C@H](CO)O

Computed by PubChem (NCBI)

Synonyms: Kirenol, Kirenol (Standard), orb1302297, orb3140451, Kirenol 100 |Ig/mL in Acetonitrile, Kirenol 100 microg/mL in Acetonitrile

Isomers (same molecular formula)

12-(2-methylprop-2-enoyloxy)dodecyl 2-methylprop-2-enoate C₂₀H₃₄O₄

(5R,6E,8Z,10E,12S)-5,12-dihydroxyicosa-6,8,10-trienoic acid C₂₀H₃₄O₄

1,4-ditert-butyl-2,5-bis(2-methoxyethoxy)benzene C₂₀H₃₄O₄

(5Z,11Z,14Z)-8,9-dihydroxyicosa-5,11,14-trienoic acid C₂₀H₃₄O₄

7-[(1R,2R)-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]heptanoic acid C₂₀H₃₄O₄

(8Z,11Z,14Z)-5,6-dihydroxyicosa-8,11,14-trienoic acid C₂₀H₃₄O₄

(1S,2S,5R,6R,7R,10S,12R,13R)-6,13-bis(hydroxymethyl)-2,6-dimethyltetracyclo[10.3.1.01,10.02,7]hexadecane-5,13-diol C₂₀H₃₄O₄

(3S,4S)-4-[(E,2S,6R,8S,9R,10R)-9-hydroxy-4,6,8,10-tetramethyl-7-oxododec-4-en-2-yl]-3-methyloxetan-2-one C₂₀H₃₄O₄

(Z)-7-[(1R,2S,5R)-2-hydroxy-5-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoic acid C₂₀H₃₄O₄

(1R,2S,3S,4R,4aS,8aS)-4-[(1E,3E)-5-hydroxy-3-methylpenta-1,3-dienyl]-3,4a,8,8-tetramethyl-2,4,5,6,7,8a-hexahydro-1H-naphthalene-1,2,3-triol C₂₀H₃₄O₄

(Z)-7-[(1R,2R,5R)-2-hydroxy-5-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoic acid C₂₀H₃₄O₄

(2R,4aR,4bS,7S,9S,10aS)-7-[(1R)-1,2-dihydroxyethyl]-1,1,4a,7-tetramethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-2,9-diol C₂₀H₃₄O₄