Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C30H32Cl3N3O4.ClH |
| Molecular Weight | 641.413 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CCN(CC)CCOC(=O)[C@H](CC1=CC=C(NC(=O)C2=C(Cl)C=CC=C2Cl)C=C1)NC(=O)C3=C(C)C=CC=C3Cl
InChI
InChIKey=CNNHYZRRGXZIIA-UQIIZPHYSA-N
InChI=1S/C30H32Cl3N3O4.ClH/c1-4-36(5-2)16-17-40-30(39)25(35-28(37)26-19(3)8-6-9-22(26)31)18-20-12-14-21(15-13-20)34-29(38)27-23(32)10-7-11-24(27)33;/h6-15,25H,4-5,16-18H2,1-3H3,(H,34,38)(H,35,37);1H/t25-;/m0./s1
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C29712
Created by
admin on Fri Dec 15 16:04:14 UTC 2023 , Edited by admin on Fri Dec 15 16:04:14 UTC 2023
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C75971
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RR-72
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100000126342
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DTXSID701002935
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828271-96-1
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XN95730F0N
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SUB32888
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11563635
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CHEMBL2107792
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ACTIVE MOIETY
SUBSTANCE RECORD