Terminology Service for NFDI4Health
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ascr#8(1-)

Go to external page http://purl.obolibrary.org/obo/CHEBI_139713

Conjugate base of ascr#8

Term info

Label

ascr#8(1-)

Subsets

2_STAR

charge

-1

formula

C20H26NO7

has obo namespace

chebi_ontology

id

CHEBI:139713

inchi

InChI=1S/C20H27NO7/c1-12(27-20-17(23)11-16(22)13(2)28-20)5-3-4-6-18(24)21-15-9-7-14(8-10-15)19(25)26/h4,6-10,12-13,16-17,20,22-23H,3,5,11H2,1-2H3,(H,21,24)(H,25,26)/p-1/b6-4+/t12-,13+,16-,17-,20-/m1/s1

inchikey

WMKIQPAVTRWYKZ-XPUFHXNMSA-M

mass

392.424

monoisotopicmass

392.17148

smiles

C[C@H](CC/C=C/C(=O)NC1=CC=C(C=C1)C([O-])=O)O[C@@H]2O[C@@H](C)[C@H](O)C[C@H]2O

Term relations