| SpectraBase Spectrum ID |
9WtL859JWH6 |
| Name |
2,16-Dioxa-6,9,20,23-tetraazatricyclo[24.2.2.2(12,15)]dotriaconta-12,14,26,28,29,31-hexaene-5,8,19,22-tetrone, 7,21-bis(2-methylpropyl)-, [7S-(7R*,21R*)]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
608.357385276 u |
| Formula |
C34H48N4O6 |
| InChI |
InChI=1S/C34H48N4O6/c1-23(2)21-29-33(41)35-17-13-25-5-9-28(10-6-25)44-20-16-32(40)38-30(22-24(3)4)34(42)36-18-14-26-7-11-27(12-8-26)43-19-15-31(39)37-29/h5-12,23-24,29-30H,13-22H2,1-4H3,(H,35,41)(H,36,42)(H,37,39)(H,38,40)/t29-,30-/m0/s1 |
| InChIKey |
LZNQUDOXTUSVEA-KYJUHHDHSA-N |
| Molecular Weight |
608.780 g/mol |
| SMILES |
[C@@]1(NC(CCOC2=CC=C(CCNC([C@@](NC(CCOC3=CC=C(CCNC1=O)C=C3)=O)(CC(C)C)[H])=O)C=C2)=O)(CC(C)C)[H] |
![2,16-Dioxa-6,9,20,23-tetraazatricyclo[24.2.2.2(12,15)]dotriaconta-12,14,26,28,29,31-hexaene-5,8,19,22-tetrone, 7,21-bis(2-methylpropyl)-, [7S-(7R*,21R*)]-](/api/spectrum/9WtL859JWH6/structure.png?h=300&w=458 "2,16-Dioxa-6,9,20,23-tetraazatricyclo[24.2.2.2(12,15)]dotriaconta-12,14,26,28,29,31-hexaene-5,8,19,22-tetrone, 7,21-bis(2-methylpropyl)-, [7S-(7R*,21R*)]-")
