Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C32H37ClN2O3.C6H8O7 |
Molecular Weight | 725.224 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.CC(C)(O)C1=CC=C2OCC3=C(C=CC=N3)\C(=C/CCN4CC[C@](O)(C5=CC=C(Cl)C=C5)C(C)(C)C4)C2=C1
InChI
InChIKey=NIEVJXSHSCNCLW-VHAXWJLBSA-N
InChI=1S/C32H37ClN2O3.C6H8O7/c1-30(2)21-35(18-15-32(30,37)22-9-12-24(33)13-10-22)17-6-8-25-26-7-5-16-34-28(26)20-38-29-14-11-23(19-27(25)29)31(3,4)36;7-3(8)1-6(13,5(11)12)2-4(9)10/h5,7-14,16,19,36-37H,6,15,17-18,20-21H2,1-4H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/b25-8+;/t32-;/m0./s1
Approval Year
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891862-87-6
Created by
admin on Sat Dec 16 11:32:47 GMT 2023 , Edited by admin on Sat Dec 16 11:32:47 GMT 2023
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11527773
Created by
admin on Sat Dec 16 11:32:47 GMT 2023 , Edited by admin on Sat Dec 16 11:32:47 GMT 2023
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RU8V7KXI4Y
Created by
admin on Sat Dec 16 11:32:47 GMT 2023 , Edited by admin on Sat Dec 16 11:32:47 GMT 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD