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CHEBI:41078 - 2,3-BIS-BENZO[1,3]DIOXOL-5-YLMETHYL-SUCCINIC ACID

Default Structure
ChEBI IDCHEBI:41078
ChEBI Name2,3-BIS-BENZO[1,3]DIOXOL-5-YLMETHYL-SUCCINIC ACID
Stars
DownloadsMolfile
FormulaC20H18O8
Net Charge0
Average Mass386.356
Monoisotopic Mass386.10017
SMILES[H]OC(=O)[C@@]([H])(C([H])([H])c1c([H])c([H])c2c(c1[H])OC([H])([H])O2)[C@@]([H])(C(=O)O[H])C([H])([H])c1c([H])c([H])c2c(c1[H])OC([H])([H])O2
InChIInChI=1S/C20H18O8/c21-19(22)13(5-11-1-3-15-17(7-11)27-9-25-15)14(20(23)24)6-12-2-4-16-18(8-12)28-10-26-16/h1-4,7-8,13-14H,5-6,9-10H2,(H,21,22)(H,23,24)/t13-,14-/m0/s1
InChIKeyFFYBYVPVYLMLAR-KBPBESRZSA-N
ChEBI Ontology
Outgoing Relation(s)
2,3-BIS-BENZO[1,3]DIOXOL-5-YLMETHYL-SUCCINIC ACID (CHEBI:41078) is a unclassifieds (CHEBI:27189)
Synonyms  Source
2,3-BIS-BENZO[1,3]DIOXOL-5-YLMETHYL-SUCCINIC ACIDPDBeChem
(2S,3S)-2,3-bis(1,3-benzodioxol-5-ylmethyl)butanedioic acidPDBeChem
Manual XrefsDatabases
BDSPDBeChem