Cas no 69461-07-0 (2-[2-[(6R,6As,10aS)-7,7,9-trimethyl-11-[2-(methylamino)ethyl]-6,6a,8,10a-tetrahydroisoindolo[2,1-a]indol-6-yl]-1H-indol-3-yl]-N-methylethanamine)

2-[2-[(6R,6As,10aS)-7,7,9-trimethyl-11-[2-(methylamino)ethyl]-6,6a,8,10a-tetrahydroisoindolo[2,1-a]indol-6-yl]-1H-indol-3-yl]-N-methylethanamine structure
69461-07-0 structure
Product Name:2-[2-[(6R,6As,10aS)-7,7,9-trimethyl-11-[2-(methylamino)ethyl]-6,6a,8,10a-tetrahydroisoindolo[2,1-a]indol-6-yl]-1H-indol-3-yl]-N-methylethanamine
CAS No:69461-07-0
MF:C32H40N4
MW:480.686807632446
CID:521698
Update Time:2024-03-01

2-[2-[(6R,6As,10aS)-7,7,9-trimethyl-11-[2-(methylamino)ethyl]-6,6a,8,10a-tetrahydroisoindolo[2,1-a]indol-6-yl]-1H-indol-3-yl]-N-methylethanamine Chemical and Physical Properties

Names and Identifiers

    • 6H-Isoindolo[2,1-a]indole-11-ethanamine,6a,7,8,10a-tetrahydro-N,7,7,9-tetramethyl-6-[3-[2-(methylamino)ethyl]-1H-indol-2-yl]-,(6R,6aS,10aS)-rel-
    • (6R)-6aβ,7,8,10aβ-Tetrahydro-7,7,9-trimethyl-11-[2-(methylamino)ethyl]-6β-[3-[2-(methylamino)ethyl]-1H-indol-2-yl]-6H-isoindolo[2,1-a]indole
    • (?à)-Isoborreverine
    • 6H-Isoindolo[2,1-a]indole-11-ethanamine,6a,7,8,10a-tetrahydro-N,7,7,9-tetramethyl-6-[3-[2-(methylamino)ethyl]-1H-indol-2-yl]-,(6a,6aa,10aa)-
    • Isoborreverine
    • 2-[2-[(6R,6As,10aS)-7,7,9-trimethyl-11-[2-(methylamino)ethyl]-6,6a,8,10a-tetrahydroisoindolo[2,1-a]i
    • 2-[2-[(6R,6As,10aS)-7,7,9-trimethyl-11-[2-(methylamino)ethyl]-6,6a,8,10a-tetrahydroisoindolo[2,1-a]indol-6-yl]-1H-indol-3-yl]-N-methylethanamine
    • Inchi： 1S/C32H40N4/c1-20-18-25-28(32(2,3)19-20)31(29-23(14-16-33-4)21-10-6-8-12-26(21)35-29)36-27-13-9-7-11-22(27)24(30(25)36)15-17-34-5/h6-13,18,25,28,31,33-35H,14-17,19H2,1-5H3/t25-,28+,31+/m0/s1
    • InChI Key： FBZQUXDSJCSNQP-BOBPPRSMSA-N
    • SMILES： N12C3C=CC=CC=3C(CCNC)=C1[C@H]1C=C(C)CC(C)(C)[C@H]1[C@@H]2C1=C(CCNC)C2C=CC=CC=2N1

Computed Properties

  • Exact Mass: 480.325
  • Monoisotopic Mass: 480.325
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 36
  • Rotatable Bond Count: 7
  • Complexity: 806
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 3
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 44.8

2-[2-[(6R,6As,10aS)-7,7,9-trimethyl-11-[2-(methylamino)ethyl]-6,6a,8,10a-tetrahydroisoindolo[2,1-a]indol-6-yl]-1H-indol-3-yl]-N-methylethanamine Related Literature

Related Categories

69461-07-0 (2-[2-[(6R,6As,10aS)-7,7,9-trimethyl-11-[2-(methylamino)ethyl]-6,6a,8,10a-tetrahydroisoindolo[2,1-a]indol-6-yl]-1H-indol-3-yl]-N-methylethanamine) Related Products

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