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5.alpha.,10.alpha.,15.alpha.-Trihydroxy-5.beta.,10.beta.,15.beta.-tris(2'-methoxyphenyl)-10,15-dihydro-5H-diindeno[1,2-a : 1',2'-c]fluorene

View entire compound with spectra: 1 NMR, and 1 MS (GC)

5.alpha.,10.alpha.,15.alpha.-Trihydroxy-5.beta.,10.beta.,15.beta.-tris(2'-methoxyphenyl)-10,15-dihydro-5H-diindeno[1,2-a : 1',2'-c]fluorene
SpectraBase Compound ID JPIXa9H3NF
InChI InChI=1S/C48H36O6/c1-52-37-25-13-10-22-34(37)46(49)31-19-7-4-16-28(31)40-43(46)41-29-17-5-8-20-32(29)47(50,35-23-11-14-26-38(35)53-2)45(41)42-30-18-6-9-21-33(30)48(51,44(40)42)36-24-12-15-27-39(36)54-3/h4-27,49-51H,1-3H3/t46-,47-,48-/m1/s1
InChIKey FMDJFZJJTYYUAT-VJOZVQJDSA-N
Mol Weight 708.8 g/mol
Molecular Formula C48H36O6
Exact Mass 708.251189 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AGqMfmWV7GD
Name 5.alpha.,10.alpha.,15.alpha.-Trihydroxy-5.beta.,10.beta.,15.beta.-tris(2'-methoxyphenyl)-10,15-dihydro-5H-diindeno[1,2-A : 1',2'-C]fluorene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 708.251188873 u
Formula C48H36O6
InChI InChI=1S/C48H36O6/c1-52-37-25-13-10-22-34(37)46(49)31-19-7-4-16-28(31)40-43(46)41-29-17-5-8-20-32(29)47(50,35-23-11-14-26-38(35)53-2)45(41)42-30-18-6-9-21-33(30)48(51,44(40)42)36-24-12-15-27-39(36)54-3/h4-27,49-51H,1-3H3/t46-,47-,48-/m1/s1
InChIKey FMDJFZJJTYYUAT-VJOZVQJDSA-N
SMILES [C@]1(C=2C(=C3[C@@](C=4C=CC=CC4C3=C3[C@@](C=4C(OC)=CC=CC4)(O)C4=C(C23)C=CC=C4)(C=2C(OC)=CC=CC2)O)C2=C1C=CC=C2)(C1=C(OC)C=CC=C1)O