SpectraBase Compound ID | 7wQoHsAp2zY |
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InChI | InChI=1S/C31H54O5Si/c1-21-13-14-25-30(8)17-12-16-29(6,7)24(30)15-18-31(25,9)26(21)27(33)34-19-23(36-22(2)32)20-35-37(10,11)28(3,4)5/h13,23-26H,12,14-20H2,1-11H3/t23-,24?,25-,26+,30+,31-/m1/s1 |
InChIKey | PLOAPZDSIGCNFJ-VQLRWERWSA-N |
Mol Weight | 534.9 g/mol |
Molecular Formula | C31H54O5Si |
Exact Mass | 534.374051 g/mol |
SpectraBase Spectrum ID | IuvoVY4hSDX |
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Name | (-)-ent-Isocapalic acid 2-Acetyl-3-(t-butyldimethylsilyl)glycerol ester |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C31H54O5Si |
InChI | InChI=1S/C31H54O5Si/c1-21-13-14-25-30(8)17-12-16-29(6,7)24(30)15-18-31(25,9)26(21)27(33)34-19-23(36-22(2)32)20-35-37(10,11)28(3,4)5/h13,23-26H,12,14-20H2,1-11H3/t23-,24?,25-,26+,30+,31-/m1/s1 |
InChIKey | PLOAPZDSIGCNFJ-VQLRWERWSA-N |
Molecular Weight | 534.853 g/mol |
SMILES | [C@]12([C@@]([C@]3(CCCC(C3CC2)(C)C)C)(CC=C([C@]1(C(OC[C@@](OC(=O)C)(CO[Si](C(C)(C)C)(C)C)[H])=O)[H])C)[H])C |
SPLASH | splash10-05r0-0951300000-a140e14fe08eb61cc362 |
Source of Spectrum | F-56-2512-3h |
Synonyms | (1R,4aR,4bS,10aR)-2,4b,8,8,10a-pentamethyl-4,4a,5,6,7,8a,9,10-octahydro-1H-phenanthrene-1-carboxylic acid [(2R)-2-acetyloxy-3-[tert-butyl(dimethyl)silyl]oxypropyl] ester [(2R)-2-acetyloxy-3-[tert-butyl(dimethyl)silyl]oxypropyl] (1R,4aR,4bS,10aR)-2,4b,8,8,10a-pentamethyl-4,4a,5,6,7,8a,9,10-octahydro-1H-phenanthrene-1-carboxylate [(2R)-2-acetoxy-3-[tert-butyl(dimethyl)silyl]oxy-propyl] (1R,4aR,4bS,10aR)-2,4b,8,8,10a-pentamethyl-4,4a,5,6,7,8a,9,10-octahydro-1H-phenanthrene-1-carboxylate [(2R)-2-acetyloxy-3-[tert-butyl(dimethyl)silyl]oxy-propyl] (1R,4aR,4bS,10aR)-2,4b,8,8,10a-pentamethyl-4,4a,5,6,7,8a,9,10-octahydro-1H-phenanthrene-1-carboxylate |
Wiley ID | 856606 |