Concept information
Preferred term
2،3،5 تریکافئول ترریک اسید
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C33H28O17
inchi
- InChI=1S/C33H28O17/c34-19-7-1-16(13-22(19)37)4-10-25(40)31(48,29(44)45)28(43)32(49,26(41)11-5-17-2-8-20(35)23(38)14-17)33(50,30(46)47)27(42)12-6-18-3-9-21(36)24(39)15-18/h1-15,28,34-39,43,48-50H,(H,44,45)(H,46,47)/b10-4+,11-5+,12-6+/t28-,31+,32-,33-/m1/s1
inchikey
- VMAVVUMWBGQKDI-IHQARNGASA-N
mass
- 696.570
monoisotopicmass
- 696.13265
smiles
- O[C@@H]([C@@](O)([C@@](O)(C(=O)/C=C/C1=CC(O)=C(O)C=C1)C(O)=O)C(=O)/C=C/C2=CC(O)=C(O)C=C2)[C@@](O)(C(=O)/C=C/C3=CC(O)=C(O)C=C3)C(O)=O
subset
- 2_STAR
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:147305
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