Concept information
Preferred term
(2r,3r,4r,5s)-6-/{[7-carbamoyl-5-hydroxy-1-(4-phenylbutan-2-yl)indol-6-yl]oxy/}-3,4,5-trihydroxyoxane-2-carboxylic acid
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C25H28N2O9
inchi
- InChI=1S/C25H28N2O9/c1-12(7-8-13-5-3-2-4-6-13)27-10-9-14-11-15(28)21(16(17(14)27)23(26)32)35-25-20(31)18(29)19(30)22(36-25)24(33)34/h2-6,9-12,18-20,22,25,28-31H,7-8H2,1H3,(H2,26,32)(H,33,34)/t12?,18-,19-,20+,22-,25?/m0/s1
inchikey
- VSZHKDAEFMNOJF-ZGXCYHSQSA-N
mass
- 500.499
monoisotopicmass
- 500.179
smiles
- O=C(N)C1=C(OC2O[C@H](C(=O)O)[C@@H](O)[C@@H]([C@H]2O)O)C(O)=CC3=C1N(C=C3)C(CCC4=CC=CC=C4)C
subset
- 2_STAR
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:143447
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