| SpectraBase Spectrum ID |
KbHVlyWq0nv |
| Name |
4H-1,16-Etheno-5,15-(propaniminoethano)furo[3,4-l][1,5,10]triazacyclohexadecine-4,21-dione, 3,3a,6,7,8,9,10,11,12,13,14,15-dodecahydro-3-(4-hydroxyphenyl)- |
| Alternate Name(s) |
Aphelandrine |
| CAS Registry Number |
75363-58-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H36N4O4 |
| InChI |
InChI=1S/C28H36N4O4/c33-21-8-5-19(6-9-21)27-26-22-17-20(7-10-24(22)36-27)23-18-25(34)31-14-4-16-32(28(26)35)15-2-1-11-29-12-3-13-30-23/h5-10,17,23,26-27,29-30,33H,1-4,11-16,18H2,(H,31,34) |
| InChIKey |
ASCIWXOCZAWSON-UHFFFAOYSA-N |
| Molecular Weight |
492.620 g/mol |
| SMILES |
N1C(CC2c3ccc4c(c3)C(C(c3ccc(cc3)O)O4)C(N(CCCCNCCCN2)CCC1)=O)=O |
| SPLASH |
splash10-0feb-9880200000-11350f8babe9f7187ad7 |
| Source of Spectrum |
W5-36568-28968-28968 |
| Wiley ID |
1397591 |
![4H-1,16-Etheno-5,15-(propaniminoethano)furo[3,4-l][1,5,10]triazacyclohexadecine-4,21-dione, 3,3a,6,7,8,9,10,11,12,13,14,15-dodecahydro-3-(4-hydroxyphenyl)-](/api/spectrum/KbHVlyWq0nv/structure.png?h=300&w=458 "4H-1,16-Etheno-5,15-(propaniminoethano)furo[3,4-l][1,5,10]triazacyclohexadecine-4,21-dione, 3,3a,6,7,8,9,10,11,12,13,14,15-dodecahydro-3-(4-hydroxyphenyl)-")
