SpectraBase Spectrum ID |
DsEnbN7a2rT |
Name |
Methyl 6-[3-(benzo[d][1,3]-dioxolan-2-yl)acylamino]penicillanate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C19H20N2O6S |
InChI |
InChI=1S/C19H20N2O6S/c1-19(2)15(18(24)25-3)21-16(23)14(17(21)28-19)20-13(22)7-5-10-4-6-11-12(8-10)27-9-26-11/h4-8,14-15,17H,9H2,1-3H3,(H,20,22)/b7-5+/t14-,15+,17-/m1/s1 |
InChIKey |
GRHIPSFVRRXMHW-QYMIHNKOSA-N |
Molecular Weight |
404.437 g/mol |
SMILES |
N([C@@]1(C(N2[C@@]1(SC([C@@]2(C(=O)OC)[H])(C)C)[H])=O)[H])C(\C=C\c1cc2OCOc2cc1)=O |
SPLASH |
splash10-00di-0901000000-b8835282aaf25750293f |
Source of Spectrum |
Y1-46-1129-5 |
Wiley ID |
1622382 |