SpectraBase Spectrum ID |
Gq1TVyKfSle |
Name |
Cycleanine - .beta.-N-Oxide |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C38H42N2O7 |
InChI |
InChI=1S/C38H42N2O7/c1-39-17-15-25-21-31(42-3)35(44-5)37-33(25)29(39)19-23-7-11-28(12-8-23)47-38-34-26(22-32(43-4)36(38)45-6)16-18-40(2,41)30(34)20-24-9-13-27(46-37)14-10-24/h7-14,21-22,29-30H,15-20H2,1-6H3/t29-,30-,40+/m1/s1 |
InChIKey |
BJIBONWGTYBODI-OLCPLSRTSA-N |
Molecular Weight |
638.761 g/mol |
SMILES |
c12c3c(OC)c(cc2CC[N@@+]([C@@]1(Cc1ccc(Oc2c4c(CCN([C@@]4(Cc4ccc(O3)cc4)[H])C)cc(c2OC)OC)cc1)[H])([O-])C)OC |
SPLASH |
splash10-022i-0003009000-022ec779587a1d6641b5 |
Source of Spectrum |
G4-61-255-1 |
Wiley ID |
1607109 |