Concept information
Preferred term
گلوکورونید آتراتی لیژنین 2
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C25H36O10
has_functional_parent
- CHEBI:196975
- بتا دی گلوکورونیک اسید
has_role
inchi
- InChI=1S/C25H36O10/c1-10-11-3-4-15-24(2)9-12(34-23-18(28)16(26)17(27)19(35-23)22(32)33)7-13(21(30)31)14(24)5-6-25(15,8-11)20(10)29/h11-20,23,26-29H,1,3-9H2,2H3,(H,30,31)(H,32,33)/t11-,12-,13-,14-,15+,16+,17+,18-,19+,20+,23-,24-,25-/m1/s1
inchikey
- OYOQJMWAEWJXTA-WNFLXSAPSA-N
mass
- 496.553
monoisotopicmass
- 496.23085
smiles
- [H][C@]12CC[C@@]34C[C@@H](CC[C@@]3([H])[C@]1(C)C[C@@H](C[C@H]2C(O)=O)O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O)C(=C)[C@@H]4O
subset
- 3_STAR
synonym EXACT
- (2R,4R,4aR,6aR,7S,9R,11aS,11bR)-4-carboxy-7-hydroxy-11b-methyl-8-methylidenetetradecahydro-6a,9-methanocyclohepta[a]naphthalen-2-yl beta-D-glucopyranosiduronic acid
synonym RELATED
- atractyligenin 2-O-glucuronide
- atractyligenin glucuronide
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:196976
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