SpectraBase Compound ID | Gj8rvRk3drX |
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InChI | InChI=1S/C18H27NO10/c1-9(20)24-8-14(27-10(2)21)16(28-11(3)22)18-17(29-12(4)23)15-13(6-25-18)7-26-19(15)5/h13-18H,6-8H2,1-5H3/t13-,14-,15-,16-,17+,18-/m1/s1 |
InChIKey | DVHIZEZLBADDHT-NKXHUJMZSA-N |
Mol Weight | 417.41 g/mol |
Molecular Formula | C18H27NO10 |
Exact Mass | 417.163496 g/mol |
SpectraBase Spectrum ID | 6kvkBLUUX2f |
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Name | [3aR-[3a.alpha.,6.alpha.(1R*,2R*),7.beta.,7a.alpha.]]-1-[7-(Acetyloxy)hexahydro-1-methyl-3H-pyrano[4,3-c]isoxazol-6-yl]-1,2,3-propanetriol triacetate |
Comments | Less than 3 mono-isotopic peaks |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C18H27NO10 |
InChI | InChI=1S/C18H27NO10/c1-9(20)24-8-14(27-10(2)21)16(28-11(3)22)18-17(29-12(4)23)15-13(6-25-18)7-26-19(15)5/h13-18H,6-8H2,1-5H3/t13-,14-,15-,16-,17+,18-/m1/s1 |
InChIKey | DVHIZEZLBADDHT-NKXHUJMZSA-N |
Molecular Weight | 417.411 g/mol |
SMILES | [C@@]1([C@@]([C@@]([C@](OC(=O)C)(COC(=O)C)[H])(OC(=O)C)[H])(OC[C@]2([C@]1(N(OC2)C)[H])[H])[H])(OC(=O)C)[H] |
SPLASH | splash10-0006-9000100000-1be56abb8eba3f5ba4d6 |
Source of Spectrum | KC-57-1577-15 |
Synonyms | (1R,2R)-2-[(3aR,6S,7S,7aR)-7-(acetyloxy)-1-methylhexahydro-3H-pyrano[4,3-c]isoxazol-6-yl]-2-(acetyloxy)-1-[(acetyloxy)methyl]ethyl acetate acetic acid [(2R,3R)-3-[(3aR,6S,7S,7aR)-7-acetyloxy-1-methyl-3,3a,4,6,7,7a-hexahydropyrano[4,3-c]isoxazol-6-yl]-2,3-diacetyloxypropyl] ester [(2R,3R)-3-[(3aR,6S,7S,7aR)-7-acetyloxy-1-methyl-3,3a,4,6,7,7a-hexahydropyrano[4,3-c][1,2]oxazol-6-yl]-2,3-diacetyloxypropyl] acetate [(2R,3R)-3-[(3aR,6S,7S,7aR)-7-acetoxy-1-methyl-3,3a,4,6,7,7a-hexahydropyrano[4,3-c]isoxazol-6-yl]-2,3-diacetoxy-propyl] acetate [(2R,3R)-3-[(3aR,6S,7S,7aR)-7-acetyloxy-1-methyl-3,3a,4,6,7,7a-hexahydropyrano[4,3-c][1,2]oxazol-6-yl]-2,3-diacetyloxy-propyl] ethanoate |
Wiley ID | 1622963 |