General Information of the Compound
| Compound ID |
CP0418486
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| Compound Name |
TUBOCURARINE
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| Synonyms |
(+)-Tubocurarine
(+)-Tubocurarine chloride
(+)-Tubocurarine chloride hydrochloride
2,2',2'-trimethyl-6,6'-bis(methyloxy)tubocuraran-2,2'-diium-7',12'-diol dichloride
7',12'-Dihydroxy-6,6'-dimethoxy-2,2',2'-trimethyltubocuraranium
7',12'-dihydroxy-6,6'-dimethoxy-2,2',2'-trimethyltubocuraran-2'-ium
Amelizol
Chlorure de tubocurarine
Chlorure de tubocurarine [INN-French]
Cloruro de tubocurarina
Cloruro de tubocurarina [INN-Spanish]
Curarin-haf
D-(+)-Tubocurarine chloride
D-7',12'-Dihydroxy-6,6'-dimethoxy-2,2',2'-trimethyltubocuraranium chloride
D-Paracurarine chloride
D-Tubocurarine
D-Tubocurarine chloride
D-Tubocurarine dichloride
D-Tubocurarine hydrochloride
Delacurarine
Delacurarine (TN)
Dextrotubocurarine chloride
Intocostrine T
Isoquinoline alkaloid
Jex (TN)
Jexin
Metubine (TN)
Tubadil
Tubaine
Tubaine (TN)
Tubarine
Tubarine (TN)
Tubocuraranium, 7',12'-dihydroxy-6,6'-dimethoxy-2,2',2'-trimethyl-, chloride, hydrochloride
Tubocurarin
Tubocurarina cloruro
Tubocurarina cloruro [DCIT]
Tubocurarine
Tubocurarine chloride
Tubocurarine chloride (INN)
Tubocurarine chloride (TN)
Tubocurarine chloride (anhydrous)
Tubocurarine hydrochloride
Tubocurarine, chloride, hydrochloride, (+)-(8CI)
Tubocurarini chloridum
Tubocurarini chloridum [INN-Latin]
Tubocurarinum
Tubocurarinum (TN)
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| Structure |
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| Formula |
C37H41N2O6+
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| Molecular Weight |
609.743
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| Canonical SMILES |
COc1cc2CC[N+](C)(C)[C@@H]3Cc4ccc(O)c(Oc5cc6[C@H](Cc7ccc(Oc(c1O)c23)cc7)N(C)CCc6cc5OC)c4
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| InChI |
InChI=1S/C37H40N2O6/c1-38-14-12-24-19-32(42-4)33-21-27(24)28(38)16-22-6-9-26(10-7-22)44-37-35-25(20-34(43-5)36(37)41)13-15-39(2,3)29(35)17-23-8-11-30(40)31(18-23)45-33/h6-11,18-21,28-29H,12-17H2,1-5H3,(H-,40,41)/p+1/t28-,29+/m0/s1
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| InChIKey |
JFJZZMVDLULRGK-URLMMPGGSA-O
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| CAS |
31498-75-6
3671-75-8
548-18-5
57-95-4
1370-17-8
30519-12-1
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT05334, ATP-binding cassette sub-family C member 4
Protein ID: PT05367, Multidrug and toxin extrusion protein 1
Protein ID: PT05330, Multidrug and toxin extrusion protein 2
Protein ID: PT04591, Solute carrier family 22 member 2
Clinical Information about the Compound