SpectraBase Compound ID | 3RKm3DPKod1 |
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InChI | InChI=1S/C43H62O3/c1-33(2)16-10-17-34(3)18-11-19-35(4)20-12-21-36(5)22-13-23-37(6)24-14-25-38(7)26-15-30-43(9)31-29-40-32-41(45-39(8)44)27-28-42(40)46-43/h16,18,20,22,24,26-29,31-32H,10-15,17,19,21,23,25,30H2,1-9H3/b34-18+,35-20+,36-22+,37-24+,38-26+ |
InChIKey | GAQFPRSOYCFGMW-GIDANPKZSA-N |
Mol Weight | 627.0 g/mol |
Molecular Formula | C43H62O3 |
Exact Mass | 626.469896 g/mol |
SpectraBase Spectrum ID | 6BYsxCo6ILo |
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Name | Sarcochromenol - B Acetate |
Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C43H62O3 |
InChI | InChI=1S/C43H62O3/c1-33(2)16-10-17-34(3)18-11-19-35(4)20-12-21-36(5)22-13-23-37(6)24-14-25-38(7)26-15-30-43(9)31-29-40-32-41(45-39(8)44)27-28-42(40)46-43/h16,18,20,22,24,26-29,31-32H,10-15,17,19,21,23,25,30H2,1-9H3/b34-18+,35-20+,36-22+,37-24+,38-26+ |
InChIKey | GAQFPRSOYCFGMW-GIDANPKZSA-N |
Molecular Weight | 626.966 g/mol |
SMILES | c12OC(C=Cc2cc(OC(=O)C)cc1)(CC\C=C\(CC\C=C\(CC\C=C\(CC\C=C\(CC\C=C\(CCC=C(C)C)C)C)C)C)C)C |
SPLASH | splash10-0udi-0090000000-9e905a2baece7ffd4d65 |
Source of Spectrum | X2-55-1259-2 |
Wiley ID | 1604535 |