SpectraBase Spectrum ID |
DnnA69a8RZ9 |
Name |
(1'S,2"R,5'R,8'S)-8,8'-Bi{2'-(1"-Hydroxybutan-2"-yl)-3',7'-dioxa-2'-azabicyclo[3.3.0]octane} |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H32N2O6 |
InChI |
InChI=1S/C18H32N2O6/c1-3-13(5-21)19-15-11(9-25-19)7-23-17(15)18-16-12(8-24-18)10-26-20(16)14(4-2)6-22/h11-18,21-22H,3-10H2,1-2H3/t11-,12?,13-,14?,15+,16?,17+,18?/m1/s1 |
InChIKey |
IYFJHHZCHWQKNN-IXVPMCEESA-N |
Molecular Weight |
372.462 g/mol |
SMILES |
OCC(N1C2C([C@@]3([C@]4(N([C@@](CO)(CC)[H])OC[C@]4(CO3)[H])[H])[H])OCC2CO1)CC |
SPLASH |
splash10-0006-0009000000-ed19901f276314247b80 |
Source of Spectrum |
KC-0-3722-8 |
Synonyms |
(1'S,2''R,5'R,8'S)-8,8'-Bi{2'-(1''-Hydroxybutan-2''-yl)-3',7'-dioxa-2'-azabicyclo[3.3.0]octane}
(2R)-2-[(3aR,6S,6aS)-6-[1-(1-hydroxybutan-2-yl)-hexahydrofuro[3,4-c][1,2]oxazol-6-yl]-hexahydrofuro[3,4-c][1,2]oxazol-1-yl]butan-1-ol |
Wiley ID |
826949 |