SpectraBase Compound ID | IeBudjvagQJ |
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InChI | InChI=1S/C42H24O6/c1-2-14-26-25(13-1)37-27-15-3-4-16-28(27)39(44-37)31-19-7-8-20-32(31)41(46-39)35-23-11-12-24-36(35)42(48-41)34-22-10-9-21-33(34)40(47-42)30-18-6-5-17-29(30)38(26,43-37)45-40/h1-24H |
InChIKey | DMLAUTPINPEAOH-UHFFFAOYSA-N |
Mol Weight | 624.6 g/mol |
Molecular Formula | C42H24O6 |
Exact Mass | 624.157288 g/mol |
SpectraBase Spectrum ID | FRkKXQ850K7 |
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Name | 43,44,45,46,47,48-Hexaoxatridecacyclo[34.6.1.1(1,8).1(8,15).1(15,22).1(22.29).1(29,36).0(2,7).0(9,14).0(16,21).0(23,28).0(30,35).0(37,42)]dotetraconta-2(7),3,5,9(14),10,12,16(21),17,19,23(28),24,26,30(35),31,33,37(42),38,40-octadecaene |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C42H24O6 |
InChI | InChI=1S/C42H24O6/c1-2-14-26-25(13-1)37-27-15-3-4-16-28(27)39(44-37)31-19-7-8-20-32(31)41(46-39)35-23-11-12-24-36(35)42(48-41)34-22-10-9-21-33(34)40(47-42)30-18-6-5-17-29(30)38(26,43-37)45-40/h1-24H |
InChIKey | DMLAUTPINPEAOH-UHFFFAOYSA-N |
Molecular Weight | 624.648 g/mol |
SMILES | C123OC4(OC5(OC6(OC7(OC(O3)(c3c7cccc3)c3c2cccc3)c2c6cccc2)c2c5cccc2)c2c4cccc2)c2c1cccc2 |
SPLASH | splash10-00fr-0000009000-b0dd9b3bcdbefccd10c4 |
Source of Spectrum | J-58-7155-3 |
Wiley ID | 1411806 |