SpectraBase Spectrum ID |
IpbjMwVobxc |
Name |
D-allo-Inositol, 3-(carboxymethylamino)-2,3-dideoxy-5,6-O-(1-methylethylidene)-, intramol. 3,4-ester |
CAS Registry Number |
73111-91-8 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C11H17NO5 |
InChI |
InChI=1S/C11H17NO5/c1-11(2)16-8-6(13)4-5-7(9(8)17-11)15-10(14)12(5)3/h5-9,13H,4H2,1-3H3/t5-,6+,7-,8+,9+/m0/s1 |
InChIKey |
IBCWPTFIOXSIEB-KVEIKIFDSA-N |
Molecular Weight |
243.259 g/mol |
SMILES |
O[C@@]1(C[C@]2([C@@]([C@@]3([C@@]1(OC(O3)(C)C)[H])[H])(OC(=O)N2C)[H])[H])[H] |
SPLASH |
splash10-004i-9660000000-82b262096eae41c42805 |
Source of Spectrum |
H-62-2429-0 |
Synonyms |
(3aR,4R,5aS,8aS,8bR)-4-hydroxy-2,2,6-trimethylhexahydro[1,3]dioxolo[4,5-g][1,3]benzoxazol-7(3aH)-one
(3aS,5R,6R,7R,7aS)-5,6,7-trihydroxy-6,7-O-isopropylidene-N-methylcyclohexano[d][1,3]oxazolidin-2-one
1,3-Dioxolo[4,5-g]benzoxazole, D-allo-inositol deriv. |
Wiley ID |
1245905 |