Concept information
Preferred term
niruriside
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C38H42O17
has_functional_parent
has_role
inchi
- InChI=1S/C38H42O17/c1-22(39)47-20-29-34(50-24(3)41)33(46)35(51-25(4)42)37(52-29)55-38(21-49-23(2)40)36(53-31(44)18-16-27-13-9-6-10-14-27)32(45)28(54-38)19-48-30(43)17-15-26-11-7-5-8-12-26/h5-18,28-29,32-37,45-46H,19-21H2,1-4H3/b17-15+,18-16+/t28-,29-,32-,33+,34-,35-,36+,37+,38+/m1/s1
inchikey
- KUZYDHCVYKUFKF-LPLPFJSBSA-N
mass
- 770.72990
monoisotopicmass
- 770.24220
smiles
- CC(=O)OC[C@H]1O[C@@H](O[C@]2(COC(C)=O)O[C@H](COC(=O)/C=C/c3ccccc3)[C@@H](O)[C@@H]2OC(=O)/C=C/c2ccccc2)[C@H](OC(C)=O)[C@@H](O)[C@@H]1OC(C)=O
subset
- 3_STAR
synonym EXACT
- 1-O-acetyl-3,6-bis-O-[(2E)-3-phenylprop-2-enoyl]-beta-D-fructofuranosyl 2,4,6-tri-O-acetyl-beta-D-glucopyranoside
synonym RELATED
- alpha-D-Glucopyranoside, 1-O-acetyl-3,6-bis-O-(1-oxo-3-phenyl-2-propenyl)-beta-D-fructofuranosyl, 2,4,6-triacetate, (E,E)-
- beta-D-(1-O-acetyl-3,6-O-trans-dicinnamoyl)fructofuranosyl alpha-D-(2,4,6-O-triacetyl)glucopyranoside
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:66627
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