SpectraBase Spectrum ID |
FSJmgxWbkd5 |
Name |
2,8-axial,axial-Bis(diethylamido)-25,27-dihydroxy)-26,28-dipropoxycalix[4]arane |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C44H54N2O6 |
InChI |
InChI=1S/C44H54N2O6/c1-7-25-51-41-31-19-13-20-32(41)28-30-18-15-22-34(40(30)48)38(44(50)46(11-5)12-6)36-24-16-23-35(42(36)52-26-8-2)37(43(49)45(9-3)10-4)33-21-14-17-29(27-31)39(33)47/h13-24,37-38,47-48H,7-12,25-28H2,1-6H3 |
InChIKey |
KMDOXXNUDJVXHJ-UHFFFAOYSA-N |
Molecular Weight |
706.924 g/mol |
SMILES |
Oc1c2C(c3c(c(C(c4c(c(Cc5c(c(Cc1ccc2)ccc5)OCCC)ccc4)O)C(N(CC)CC)=O)ccc3)OCCC)C(N(CC)CC)=O |
SPLASH |
splash10-0002-0000019000-c422e137fad9f46e2d3f |
Source of Spectrum |
J-65-672-7 |
Synonyms |
2,8-axial,equatorial-Bis(diethylamido)-25,27-dihydroxy)-26,28-dipropoxycalix[4]arane |
Wiley ID |
1532104 |