Concept information
Preferred term
پتونیدین 3 O بتا گلوکوزید بتائین
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C22H22O12
inchi
- InChI=1S/C22H22O12/c1-31-14-3-8(2-12(26)17(14)27)21-15(6-10-11(25)4-9(24)5-13(10)32-21)33-22-20(30)19(29)18(28)16(7-23)34-22/h2-6,16,18-20,22-23,28-30H,7H2,1H3,(H3-,24,25,26,27)/t16-,18-,19+,20-,22-/m1/s1
inchikey
- CCQDWIRWKWIUKK-QKYBYQKWSA-N
mass
- 478.406
monoisotopicmass
- 478.11113
smiles
- C1(=C(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)CO)C=C3C(=[O+]1)C=C(O)C=C3[O-])C4=CC(=C(O)C(=C4)OC)O
subset
- 2_STAR
synonym RELATED
- petunidin 3-O-beta-D-glucoside
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:193103
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