SpectraBase Spectrum ID |
4xXAlTRlA2c |
Name |
23,24-Dicarbomethoxy-9,10-diphenylundecacyclo[16.10.1,1(4,15).1(21,26).0(2,17).0(3,16).0(5,14).0(7,12).0(20,27).0(19,28).0(22,25)]octacosa-5,7,9,11,13,23-hexene |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C47H42O4 |
InChI |
InChI=1S/C47H42O4/c1-50-46(48)44-42-32-19-33(43(42)45(44)47(49)51-2)41-39-31-18-30(38(39)40(32)41)36-34-28-17-29(35(34)37(31)36)27-16-23-14-25(21-11-7-4-8-12-21)24(13-22(23)15-26(27)28)20-9-5-3-6-10-20/h3-16,28-43H,17-19H2,1-2H3/t28-,29+,30-,31+,32-,33+,34-,35?,36?,37+,38?,39?,40-,41?,42-,43?/m0/s1 |
InChIKey |
KEAHUDTUNZMWRH-UHFFFAOYSA-N |
Molecular Weight |
670.849 g/mol |
SMILES |
C1(=C(C(=O)OC)C2[C@@]1([C@@]1([C@]3(C4[C@@]5(C6[C@]7([C@@]8(c9cc%10cc(-c%11ccccc%11)c(cc%10cc9[C@](C7[C@]6([C@](C4C3[C@]2(C1)[H])(C5)[H])[H])(C8)[H])-c1ccccc1)[H])[H])[H])[H])[H])[H])C(=O)OC |
SPLASH |
splash10-00di-0001009000-12dba40dd059a043e00c |
Source of Spectrum |
KC-61-6974-7 |
Wiley ID |
1629860 |