Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C56H78N2O16.2Cl |
| Molecular Weight | 1106.128 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
| Stereo Comments | MESO |
SHOW SMILES / InChI
SMILES
[Cl-].[Cl-].COC1=CC(C[C@H]2C3=C(CC[N@+]2(C)CCCOC(=O)CCC(=O)OCCC[N@+]4(C)CCC5=C([C@H]4CC6=CC(OC)=C(OC)C(OC)=C6)C(OC)=C(OC)C(OC)=C5)C=C(OC)C(OC)=C3OC)=CC(OC)=C1OC
InChI
InChIKey=APADFLLAXHIMFU-LGIHQUBZSA-L
InChI=1S/C56H78N2O16.2ClH/c1-57(23-19-37-33-45(65-7)53(69-11)55(71-13)49(37)39(57)27-35-29-41(61-3)51(67-9)42(30-35)62-4)21-15-25-73-47(59)17-18-48(60)74-26-16-22-58(2)24-20-38-34-46(66-8)54(70-12)56(72-14)50(38)40(58)28-36-31-43(63-5)52(68-10)44(32-36)64-6;;/h29-34,39-40H,15-28H2,1-14H3;2*1H/q+2;;/p-2/t39-,40+,57-,58+;;
Approval Year
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MN728NK085
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DB01135
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106819-53-8
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5284551
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DTXSID7022962
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admin on Mon Mar 31 17:37:07 GMT 2025 , Edited by admin on Mon Mar 31 17:37:07 GMT 2025
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m4750
Created by
admin on Mon Mar 31 17:37:07 GMT 2025 , Edited by admin on Mon Mar 31 17:37:07 GMT 2025
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ACTIVE MOIETY
SUBSTANCE RECORD