| SpectraBase Spectrum ID |
HCquUrrpgVd |
| Name |
Dimethyl-secantioquine |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C39H42N2O8 |
| InChI |
InChI=1S/C39H42N2O8/c1-40-14-13-26-20-35(47-6)37(48-7)38(49-34-21-27-25(19-33(34)46-5)12-15-41(2)39(27)43)36(26)30(40)18-23-8-10-31(44-3)28(16-23)29-17-24(22-42)9-11-32(29)45-4/h8-11,16-17,19-22,30H,12-15,18H2,1-7H3/t30-/m0/s1 |
| InChIKey |
HKRPMAQKIGSQEQ-PMERELPUSA-N |
| Molecular Weight |
666.771 g/mol |
| SMILES |
c12c(c(OC)c(cc2CCN([C@]1(Cc1cc(-c2c(ccc(c2)C=O)OC)c(cc1)OC)[H])C)OC)Oc1cc2C(N(C)CCc2cc1OC)=O |
| SPLASH |
splash10-03di-0000901000-692c809e38cb567cc2bc |
| Source of Spectrum |
X2-48-83-14 |
| Wiley ID |
1601627 |
