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1-C-(2,3,4-triphenyl-5-methylphenyl)-D-manno-penta-O-acetylpentitol
SpectraBase Compound ID EINYvlo2Php
InChI InChI=1S/C40H40O10/c1-24-22-33(36(31-18-12-8-13-19-31)37(32-20-14-9-15-21-32)35(24)30-16-10-7-11-17-30)38(48-27(4)43)40(50-29(6)45)39(49-28(5)44)34(47-26(3)42)23-46-25(2)41/h7-22,34,38-40H,23H2,1-6H3/t34-,38-,39-,40-/m1/s1
InChIKey CBDQTPGQUUEFQF-ZTWIBWFSSA-N
Mol Weight 680.8 g/mol
Molecular Formula C40H40O10
Exact Mass 680.262147 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2P7yDJK88j2
Name 1-C-(2,3,4-triphenyl-5-methylphenyl)-D-manno-penta-O-acetylpentitol
Alternate Name(s) 2,3-bis(acetyloxy)-1-[1,2-bis(acetyloxy)-2-(5-methyl-2,3,4-triphenylphenyl)ethyl]propyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H40O10
InChI InChI=1S/C40H40O10/c1-24-22-33(36(31-18-12-8-13-19-31)37(32-20-14-9-15-21-32)35(24)30-16-10-7-11-17-30)38(48-27(4)43)40(50-29(6)45)39(49-28(5)44)34(47-26(3)42)23-46-25(2)41/h7-22,34,38-40H,23H2,1-6H3/t34-,38-,39-,40-/m1/s1
InChIKey CBDQTPGQUUEFQF-ZTWIBWFSSA-N
Molecular Weight 680.750 g/mol
SMILES c1(c(c(-c2ccccc2)c(c(c1)C)-c1ccccc1)-c1ccccc1)[C@]([C@]([C@@]([C@](OC(=O)C)(COC(=O)C)[H])(OC(=O)C)[H])(OC(=O)C)[H])(OC(=O)C)[H]
SPLASH splash10-0006-9004000000-794f38a11f23ecbb8e0d
Source of Spectrum F-51-8267-8
Wiley ID 792760