| SpectraBase Compound ID | KjU3NFmbTOP |
|---|---|
| InChI | InChI=1S/C30H38O7/c1-5-17-33-26-25(31)27(36-21-23-13-15-24(32-4)16-14-23)28(34-18-6-2)30(35-19-7-3)29(26)37-20-22-11-9-8-10-12-22/h5-16,25-31H,1-3,17-21H2,4H3/t25-,26+,27-,28+,29-,30-/m1/s1 |
| InChIKey | YXNVCDVRDKCSGZ-KLDGOVGUSA-N |
| Mol Weight | 510.6 g/mol |
| Molecular Formula | C30H38O7 |
| Exact Mass | 510.261754 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CYtUeH92gfN |
|---|---|
| Name | (-)-3,4,6-Tri-O-allyl-5-O-benzyl-1-O-(p-methoxybenzyl)-myo-inositol |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H38O7 |
| InChI | InChI=1S/C30H38O7/c1-5-17-33-26-25(31)27(36-21-23-13-15-24(32-4)16-14-23)28(34-18-6-2)30(35-19-7-3)29(26)37-20-22-11-9-8-10-12-22/h5-16,25-31H,1-3,17-21H2,4H3/t25-,26+,27-,28+,29-,30-/m1/s1 |
| InChIKey | YXNVCDVRDKCSGZ-KLDGOVGUSA-N |
| Molecular Weight | 510.627 g/mol |
| SMILES | O[C@]1([C@]([C@@]([C@]([C@](OCc2ccccc2)([C@]1(OCC=C)[H])[H])(OCC=C)[H])(OCC=C)[H])(OCc1ccc(cc1)OC)[H])[H] |
| SPLASH | splash10-0006-9000000000-ec06bf06d7dafd65235d |
| Source of Spectrum | J-63-5435-18 |
| Synonyms | (+)-3,5,6-Tri-O-allyl-4-O-benzyl-1-O-(p-methoxybenzyl)-myo-inositol (1R,2S,3R,4R,5S,6R)-2,4,5-Tris-allyloxy-3-benzyloxy-6-(4-methoxy-benzyloxy)-cyclohexanol (1S,2R,3S,4S,5R,6S)-2,4,5-tris(allyloxy)-3-(benzyloxy)-6-[(4-methoxybenzyl)oxy]cyclohexanol (1S,2R,3S,4R,5R,6S)-2,3,5-tris(allyloxy)-4-(benzyloxy)-6-[(4-methoxybenzyl)oxy]cyclohexanol (1R,2R,3S,4R,5R,6S)-2-[(4-methoxyphenyl)methoxy]-5-phenylmethoxy-3,4,6-tris(prop-2-enoxy)-1-cyclohexanol (1R,2S,3R,4R,5S,6R)-2,4,5-triallyloxy-3-benzyloxy-6-[(4-methoxyphenyl)methoxy]cyclohexanol (1R,2R,3S,4R,5R,6S)-2-[(4-methoxyphenyl)methoxy]-5-phenylmethoxy-3,4,6-tris(prop-2-enoxy)cyclohexan-1-ol |
| Wiley ID | 1400548 |