CHEBI:91667 - 3-(1,3-benzodioxol-5-yl)propane-1,2-diol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-(1,3-benzodioxol-5-yl)propane-1,2-diol
ChEBI ID CHEBI:91667
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C10H12O4
Net Charge 0
Average Mass 196.200
Monoisotopic Mass 196.07356
InChI InChI=1S/C10H12O4/c11-5-8(12)3-7-1-2-9-10(4-7)14-6-13-9/h1-2,4,8,11-12H,3,5-6H2
InChIKey FYDVPEVHFUBOJG-UHFFFAOYSA-N
SMILES C1OC2=C(O1)C=C(C=C2)CC(CO)O
ChEBI Ontology
Outgoing 3-(1,3-benzodioxol-5-yl)propane-1,2-diol (CHEBI:91667) is a benzodioxoles (CHEBI:38298)
Manual Xrefs Databases
HMDB0030571 HMDB
LSM-1505 LINCS
View more database links