| SpectraBase Compound ID | LfsOOSgk9Ek |
|---|---|
| InChI | InChI=1S/C38H42O7/c1-3-23-41-34-33(39)35(42-27-31-19-21-32(40-2)22-20-31)37(44-25-29-15-9-5-10-16-29)38(45-26-30-17-11-6-12-18-30)36(34)43-24-28-13-7-4-8-14-28/h3-22,33-39H,1,23-27H2,2H3/t33-,34+,35-,36-,37+,38+/m1/s1 |
| InChIKey | MLRCAZPIDNVTAZ-HFSACJMFSA-N |
| Mol Weight | 610.7 g/mol |
| Molecular Formula | C38H42O7 |
| Exact Mass | 610.293054 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7OVqpIpi8kz |
|---|---|
| Name | (-)-3-O-Allyl-4,5,6-tri-O-benzyl-1-O-(p-methoxybenzyl)-myo-insitol |
| Alternate Name(s) | (1R,2R,3S,4S,5R,6S)-2-[(4-methoxyphenyl)methoxy]-3,4,5-tris(phenylmethoxy)-6-prop-2-enoxy-1-cyclohexanol (1R,2R,3S,4S,5R,6S)-2-[(4-methoxyphenyl)methoxy]-3,4,5-tris(phenylmethoxy)-6-prop-2-enoxy-cyclohexan-1-ol (1R,2S,3R,4S,5S,6R)-2-allyloxy-3,4,5-tribenzoxy-6-p-anisyloxy-cyclohexanol (1R,2S,3R,4S,5S,6R)-2-allyloxy-3,4,5-tribenzyloxy-6-[(4-methoxyphenyl)methoxy]cyclohexanol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C38H42O7 |
| InChI | InChI=1S/C38H42O7/c1-3-23-41-34-33(39)35(42-27-31-19-21-32(40-2)22-20-31)37(44-25-29-15-9-5-10-16-29)38(45-26-30-17-11-6-12-18-30)36(34)43-24-28-13-7-4-8-14-28/h3-22,33-39H,1,23-27H2,2H3/t33-,34+,35-,36-,37+,38+/m1/s1 |
| InChIKey | MLRCAZPIDNVTAZ-HFSACJMFSA-N |
| Molecular Weight | 610.747 g/mol |
| SMILES | O[C@@]1([C@@]([C@]([C@@]([C@]([C@@]1(OCc1ccc(cc1)OC)[H])(OCc1ccccc1)[H])(OCc1ccccc1)[H])(OCc1ccccc1)[H])(OCC=C)[H])[H] |
| SPLASH | splash10-0006-9000020000-15d5f3afe981689a4e12 |
| Source of Spectrum | J-61-5907-8 |
| Wiley ID | 1410941 |