CAS: 101224-22-0 - BUPRENORPHINE B-D-GLUCURONIDE

Formula: C₃₅H₄₉NO₁₀

InChI: InChI=1S/C35H49NO10/c1-31(2,3)32(4,42)20-15-33-10-11-35(20,43-5)30-34(33)12-13-36(16-17-6-7-17)21(33)14-18-8-9-19(26(46-30)22(18)34)44-29-25(39)23(37)24(38)27(45-29)28(40)41/h8-9,17,20-21,23-25,27,29-30,37-39,42H,6-7,10-16H2,1-5H3,(H,40,41)/t20-,21-,23+,24+,25-,27+,29-,30-,32+,33-,34+,35-/m1/s1

InChI key: InChIKey=CZULHKGIAJASAA-WWIHBJMFSA-N

SMILES: O=C(O)C1OC(OC2=CC=C3C4=C2OC5C6(OC)CCC7(CC6C(O)(C)C(C)(C)C)C(N(CCC457)CC8CC8)C3)C(O)C(O)C1O

Synonyms:

• (5,7)-17-(Cyclopropylmethyl)-4,5-epoxy-18,19-dihydro-7-[(1S)-1-hydroxy-1,2,2,-trimethylpropyl]-6-methoxy-6,14-ethenomorphinan-3-yl -D-Glucuronide
• (57-17-(Cyclopropylmethyl)-4,5-epoxy-18,19-dihydro-7-[(1S)-1-hydroxy-1,2,2,-trimethylpropyl]-6-methoxy-6,14-ethenomorphinan-3-yl b-D-Glucuronide
• (5alpha,6beta,14beta,18R)-17-(cyclopropylmethyl)-18-[(2S)-2-hydroxy-3,3-dimethylbutan-2-yl]-6-methoxy-18,19-dihydro-4,5-epoxy-6,14-ethenomorphinan-2-yl beta-D-glucopyranosiduronic acid
• (5α,7α)-17-(Cyclopropylmethyl)-4,5-epoxy-18,19-dihydro-7-[(1S)-1-hydroxy-1,2,2-trimethylpropyl]-6-methoxy-6,14-ethenomorphinan-3-yl β-<span class="text-smallcaps">D</span>-glucopyranosiduronic acid
• Buprenorphine -D-Glucuronide
• Buprenorphine 3-glucuronide
• Buprenorphine 3-β-<span class="text-smallcaps">D</span>-glucuronide
• Buprenorphine glucuronide
• buprenorphine-3-O-glucuronide
• β-<span class="text-smallcaps">D</span>-Glucopyranosiduronic acid, (5α,7α)-17-(cyclopropylmethyl)-4,5-epoxy-18,19-dihydro-7-[(1S)-1-hydroxy-1,2,2-trimethylpropyl]-6-methoxy-6,14-ethenomorphinan-3-yl

Buprenorphine b-D-Glucuronide

CAS: 101224-22-0

Applications A metabolite of Buprenorphine (B689570). Controlled substance. References Rolleri, E., et al.: Clin. Chim. …

• Formula: C₃₅H₄₉NO₁₀
• Color and Shape: White To Off-White
• Molecular weight: 643.76

Buprenorphine beta-D-Glucuronide (100ug/ml in Methanol)

CAS: 101224-22-0

• Formula: C₃₅H₄₉NO₁₀
• Molecular weight: 643.76