SpectraBase Spectrum ID |
KVHOkA147fc |
Name |
4-Oxazolecarboxylic acid, 2-[2-methyl-3-[tetrahydro-3,4-dihydroxy-5-[[3-(2-hydroxy-1-methylpropyl)oxiranyl]methyl]-2H-pyran-2-yl]-1-propenyl]-, ethyl ester, [2S-[2.alpha.(E),3.beta.,4.beta.,5.alpha.[2R*,3R*(1R*,2R*)]]]- |
CAS Registry Number |
127862-34-4 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H33NO8 |
InChI |
InChI=1S/C22H33NO8/c1-5-28-22(27)15-10-30-18(23-15)7-11(2)6-16-20(26)19(25)14(9-29-16)8-17-21(31-17)12(3)13(4)24/h7,10,12-14,16-17,19-21,24-26H,5-6,8-9H2,1-4H3/b11-7+/t12-,13?,14+,16+,17?,19-,20+,21?/m0/s1 |
InChIKey |
IYYCAYNSFHUAEI-QJBYIHMJSA-N |
Molecular Weight |
439.505 g/mol |
SMILES |
OC([C@@](C1OC1C[C@@]1(CO[C@@]([C@]([C@]1(O)[H])(O)[H])(C\C(=C\c1nc(C(=O)OCC)co1)C)[H])[H])(C)[H])C |
SPLASH |
splash10-0002-5900000000-49ffc6afc46a9d9a7a80 |
Source of Spectrum |
KC-1989-2054-2 |
Synonyms |
4-Ethoxycarbonyl-2-normonyloxazole
Ethyl 2-[(1E)-2-{[(2R,3S,4S,5R)-3,4-dihydroxy-5-({3-[(2S)-3-hydroxybutan-2-yl]oxiran-2-yl}methyl)oxan-2-yl]methyl}prop-1-en-1-yl]-1,3-oxazole-4-carboxylate |
Wiley ID |
1384405 |