Concept information
...
pnictogen molecular entity
nitrogen molecular entity
organonitrogen compound
n-glycosyl compound
...
organooxygen compound
carbohydrates and carbohydrate derivatives
carbohydrate derivative
n-glycosyl compound
...
organooxygen compound
carbohydrates and carbohydrate derivatives
carbohydrate derivative
n-glycosyl compound
...
organooxygen compound
carbohydrates and carbohydrate derivatives
carbohydrate derivative
n-glycosyl compound
...
carbohydrates and carbohydrate derivatives
carbohydrate derivative
glycosyl compound
n-glycosyl compound
Preferred term
9'-deoxy-8',8'-dihydroxyherbicidin b
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C18H23N5O9
inchi
- InChI=1S/C18H23N5O9/c1-28-12-11-7(31-15(12)23-6-22-10-13(19)20-5-21-14(10)23)3-9-18(27,32-11)17(25,26)4-8(30-9)16(24)29-2/h5-9,11-12,15,25-27H,3-4H2,1-2H3,(H2,19,20,21)/t7-,8+,9-,11+,12-,15-,18-/m1/s1
inchikey
- AZYCCECPGKXFKD-WZBVYVGFSA-N
mass
- 453.408
monoisotopicmass
- 453.14958
smiles
- O=C(OC)[C@H]1O[C@H]2[C@](O[C@@H]3[C@@H](OC)[C@@H](O[C@@H]3C2)N4C5=NC=NC(=C5N=C4)N)(O)C(C1)(O)O
subset
- 2_STAR
synonym EXACT
- methyl (1R,3S,4R,5R,7R,9R,11S)-5-(6-aminopurin-9-yl)-1,13,13-trihydroxy-4-methoxy-2,6,10-trioxatricyclo[7.4.0.03,7]tridecane-11-carboxylate
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:208468
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