Name: Alcuronium free base
Rating: 5 (10 reviews)

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HIT ID:HIT214318962
Cas No:23214-96-2
常用名:Alcuronium free base
别名:Diallylnortoxiferine, Alloferine, Alcuronum, Alcuronium kation, Alcuronium
别名:Diallylnortoxiferine, Alloferine, Alcuronum, Alcuronium kation, Alcuronium
IUPAC:(1S,11S,13S,14R,17S,27S,28E,30R,33S,35S,37E,38S)-28,37-bis(2-hydroxyethylidene)-14,30-bis(prop-2-en-1-yl)-8,14,24,30-tetraazaundecacyclo[25.5.2.2^{11,14}.1^{1,8}.1^{10,17}.0^{2,7}.0^{13,17}.0^{18,23}.0^{30,33}.0^{24,35}.0^{26,38}]octatriaconta-2(7),3,5,9,18(23),19,21,25-octaene-14,30-diium
IUPAC:(1S,11S,13S,14R,17S,27S,28E,30R,33S,35S,37E,38S)-28,37-bis(2-hydroxyethylidene)-14,30-bis(prop-2-en-1-yl)-8,14,24,30-tetraazaundecacyclo[25.5.2.2^{11,14}.1^{1,8}.1^{10,17}.0^{2,7}.0^{13,17}.0^{18,23}.0^{30,33}.0^{24,35}.0^{26,38}]octatriaconta-2(7),3,5,9,18(23),19,21,25-octaene-14,30-diium
InChI key:MUQUYTSLDVKIOF-BBMNSBIFSA-N

分子式:C44H50N4O2
分子量:666.909
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]12C[C@@]3([H])\C(C[N@+]1(CC=C)CC[C@@]21c2ccccc2N2C=C4[C@]5([H])N(C=C3[C@@]12[H])c1ccccc1[C@@]51CC[N@@+]2(CC=C)C\C(=C\CO)[C@]4([H])C[C@@]12[H])=C/CO |w:21.23,26.28,TLB:40:39:36.23.22:50,37:36:50:39.44.43,38:39:36.23.22:50,THB:35:36:50:39.44.43,14:13:2:7.6.5,12:13:2:7.6.5,11:7:2:28.27.13|
SMILES:[H][C@@]12C[C@@]3([H])\C(C[N@+]1(CC=C)CC[C@@]21c2ccccc2N2C=C4[C@]5([H])N(C=C3[C@@]12[H])c1ccccc1[C@@]51CC[N@@+]2(CC=C)C\C(=C\CO)[C@]4([H])C[C@@]12[H])=C/CO |w:21.23,26.28,TLB:40:39:36.23.22:50,37:36:50:39.44.43,38:39:36.23.22:50,THB:35:36:50:39.44.43,14:13:2:7.6.5,12:13:2:7.6.5,11:7:2:28.27.13|

Alcuronium free base is a non-depolarizing skeletal muscle relaxant similar to Tubocurarine. It is used as an anesthesia adjuvant.

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