(3beta,5beta,12beta)-3-[2-({6-[(2,5-Dioxo-1-pyrrolidinyl)oxy]-6-oxohexyl}amino)-2-oxoethoxy]-12,14-dihydroxycard-20(22)-enolide | CAS No. 129273-26-3

(3beta,5beta,12beta)-3-[2-({6-[(2,5-Dioxo-1-pyrrolidinyl)oxy]-6-oxohexyl}amino)-2-oxoethoxy]-12,14-dihydroxycard-20(22)-enolide

Basic Information

CAS Number

129273-26-3

Molecular Formula

C35H50N2O10

Molecular Weight

658.79 g/mol

AD

Basic Physical Properties

C[C@]12CC[C@@H](C[C@H]1CC[C@@H]3[C@@H]2C[C@H]([C@]4([C@@]3(CC[C@@H]4C5=CC(=O)OC5)O)C)O)OCC(=O)NCCCCCC(=O)ON6C(=O)CCC6=O

InChI

InChI=1S/C35H50N2O10/c1-33-13-11-23(45-20-28(39)36-15-5-3-4-6-31(42)47-37-29(40)9-10-30(37)41)17-22(33)7-8-25-26(33)18-27(38)34(2)24(12-14-35(25,34)44)21-16-32(43)46-19-21/h16,22-27,38,44H,3-15,17-20H2,1-2H3,(H,36,39)/t22-,23+,24-,25-,26+,27-,33+,34+,35+/m1/s1

InChIKey

KHNDABJZSPPYLE-FUGFVFQCSA-N

LogP

2.8832000000000013

Topological Polar Surface Area

168.76999999999998 Ų

Hydrogen Bond Donor/Acceptor

3 / 12

Complexity

1300

Safety Information

View Safety Information

Hazard Statement

H373 Causes damage to organs through prolonged or repeated exposure
Specific target organ toxicity, repeated exposure

Synonyms & References

English

  • ε-(Digoxigenin-3-0-acetamido)caproic acid N-hydroxysuccinimide ester
  • DIG NHS
  • Digoxigenin NHS-ester
  • dig-nhs-ester
  • Digoxigenin-3-O-methylcarbonyl-ε-aminocaproic acid-N-hydroxysuccinimide ester
  • ω-(Digoxigenin-3-0-acetamido)caproic acid N-hydroxysuccinimide ester
  • n-hydroxysuccinimidyldigoxigenin-3-o-methylcarbonyl-epsilon-aminocaproate
  • -aminocaproic acid-N-hydroxysuccinimide ester
  • Digoxigenin-3-O-methylcarbonyl-ε
  • (3β,5β,12β)-3-[2-[[6-[(2,5-Dioxo-1-pyrrolidinyl)oxy]-6-oxohexyl]amino]-2-oxoethoxy]-12,14-dihydroxycard-20(22)-enolide
  • Digoxigenin NHS-ester >=80% (HPLC)
  • N-Hydroxysuccinimidyl digoxigenin-3-O-methylcarbonyl-epsilon-aminocaproate
  • 3-[2-({6-[(2,5-Dioxopyrrolidi
  • (2,5-dioxopyrrolidin-1-yl) 6-[[2-[[(3S,5R,8R,9S,10S,12R,13S,17R)-12,14-dihydroxy-10,13-dimethyl-17-(

MDL Number

MFCD02093394

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