Products 130668-48-3

CAS 130668-48-3 appears in our catalog under these names: Buprenorphine EP Impurity E (controlled substance), 6-O-Desmethyl Buprenorphine, >95% (HPLC), 6-O-Desmethyl Buprenorphine (1mg/ml in Acetonitrile), Desmethyl Buprenorphine, 6-O-Desmethyl buprenorphine. Offered by: Chemat Brand, TRC, Mikromol, Biosynth. Available pack sizes: on request, 25mg, 1x1ml, 5mg, 1mg, 10mg.

Buprenorphine EP Impurity E (controlled substance)
Chemat Brand
  • size: on request
  • Variants: 1
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6-O-Desmethyl Buprenorphine, >95% (HPLC)
TRC
  • size: 25mg
  • Variants: 1
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6-O-Desmethyl Buprenorphine (1mg/ml in Acetonitrile)
TRC
  • size: 1x1ml
  • Variants: 1
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Desmethyl Buprenorphine
Mikromol
  • size: 25mg
  • Variants: 1
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6-O-Desmethyl buprenorphine
Biosynth
  • size: 5mg, 1mg, 10mg
  • Variants: 3
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Structural formula: {0} (CAS {1})

(1S,2S,6R,14R,15R,16R)-5-(cyclopropylmethyl)-16-[(2S)-2-hydroxy-3,3-dimethylbutan-2-yl]-13-oxa-5-azahexacyclo[13.2.2.12,8.01,6.02,14.012,20]icosa-8(20),9,11-triene-11,15-diol (CAS 130668-48-3) is a chemical compound with the molecular formula C28H39NO4 and a molecular weight of 453.6 g/mol. IUPAC name: (1S,2S,6R,14R,15R,16R)-5-(cyclopropylmethyl)-16-[(2S)-2-hydroxy-3,3-dimethylbutan-2-yl]-13-oxa-5-azahexacyclo[13.2.2.12,8.01,6.02,14.012,20]icosa-8(20),9,11-triene-11,15-diol. InChIKey: PVQDTNRTSUTFFF-JOJQJKSDSA-N.

Identity
Molecular formulaC28H39NO4
Molecular weight453.6 g/mol
IUPAC name(1S,2S,6R,14R,15R,16R)-5-(cyclopropylmethyl)-16-[(2S)-2-hydroxy-3,3-dimethylbutan-2-yl]-13-oxa-5-azahexacyclo[13.2.2.12,8.01,6.02,14.012,20]icosa-8(20),9,11-triene-11,15-diol
InChIKeyPVQDTNRTSUTFFF-JOJQJKSDSA-N
SMILESC[C@]([C@H]1C[C@@]23CC[C@@]1([C@H]4[C@@]25CCN([C@@H]3CC6=C5C(=C(C=C6)O)O4)CC7CC7)O)(C(C)(C)C)O

Computed by PubChem (NCBI)

Synonyms: 6-O-Desmethyl Buprenorphine, Desmethyl Buprenorphine, 6-O-Demethylbuprenorphine, 6-O-Desmethyl Buprenorphine (1mg/ml in Acetonitrile), Buprenorphine EP Impurity E, BUPRENORPHINE IMPURITY E [EP IMPURITY], 6-O-Desmethyl Buprenorphine (1 mg/ml in Acetonitrile), BUPRENORPHINE HYDROCHLORIDE IMPURITY E [EP IMPURITY]