Herpetone

cas: 951677-22-8 — see every product listed under this CAS number, including other names

Herpetone (CAS 951677-22-8) is a chemical reagent available from Chemat. Available pack sizes: on request, 25mg, 1mg, 5mg, 10mg, 50mg, Get quote. Offered by: Chemat Brand, Biosynth, MedChemExpress.

brandChemat Brand
catalog numberRG-A260199
cas951677-22-8
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properties

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Structural formula: {0} (CAS {1})

2-[5-[(3S,3aR,6S,6aR)-3-(4-hydroxy-3-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-hydroxy-3-methoxyphenyl]-1-(4-hydroxy-3-methoxyphenyl)ethanone (CAS 951677-22-8) is a chemical compound with the molecular formula C29H30O9 and a molecular weight of 522.5 g/mol. IUPAC name: 2-[5-[(3S,3aR,6S,6aR)-3-(4-hydroxy-3-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-hydroxy-3-methoxyphenyl]-1-(4-hydroxy-3-methoxyphenyl)ethanone. InChIKey: NKRVXSJMQLQTTM-UGOBFYTOSA-N.

Identity
Molecular formulaC29H30O9
Molecular weight522.5 g/mol
IUPAC name2-[5-[(3S,3aR,6S,6aR)-3-(4-hydroxy-3-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-hydroxy-3-methoxyphenyl]-1-(4-hydroxy-3-methoxyphenyl)ethanone
InChIKeyNKRVXSJMQLQTTM-UGOBFYTOSA-N
SMILESCOC1=CC(=CC(=C1O)CC(=O)C2=CC(=C(C=C2)O)OC)[C@@H]3[C@H]4CO[C@@H]([C@H]4CO3)C5=CC(=C(C=C5)O)OC

Computed by PubChem (NCBI)

Synonyms: Herpetone, orb1684549
Isomers (same molecular formula)
[(2R,3R,4S,5R,6S)-3,4-dihydroxy-6-(4-methoxyphenoxy)-5-(4-methylbenzoyl)oxyoxan-2-yl]methyl 4-methylbenzoate C29H30O9