22-(Cyclopropylmethyl)-11-Methyl-14-Oxa-11,22-Diazaheptacyclo[13.9.1.0~1,13~.0~2,21~.0~4,12~.0~5,10~.0~19,25~]Pentacosa-4(12),5,7,9,15(25),16,18-Heptaene-2,16-Diol

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Formula C27H28N2O3
IUPAC Name 22-(cyclopropylmethyl)-11-methyl-14-oxa-11,22-diazaheptacyclo[13.9.1.0 1,13 .0 2,21 .0 4,12 .0 5,10 .0 19,25 ]pentacosa-4(12),5,7,9,15(25),16,18-heptaene-2,16-diol
Molecular Mass 428.523 g·mol−1
Heat of Formation 66.7 ± 16.7 kJ·mol−1
Dipole Moment 5.27 ± 1.08 D
Volume 500.99 Å 3
Surface Area 402.29 Å 2
Point Group Symmetry C1
Synonyms
  • 4,8-methanobenzofuro(2,3-a)pyrido(4,3-b)carbazole-1,8a(9h)-diol, 7-(cyclopropylmethyl)-5,6,7,8,14,14b-hexahydro-14-methyl-, (8r-(4bs*,8alpha,8abeta,14bbeta))-
  • n-methylnaltrindole
CAS Number(s)
  • 111555-57-8
InChIKey CRTCCMARDBQOKA-NVSKSXHLSA-N
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