cleomiscosin A
An organic heterotricyclic compound that is 2,3-dihydro-9H-[1,4]dioxino[2,3-h]chromen-9-one substituted by 4-hydroxy-3-methoxy phenyl group at position 3, a hydroxymethyl group at position 2 and a methoxy group at position 5 (the 2R,3R stereoisomer). It exhibits anti-inflammatory activity.
Also appears inslm
Exact Synonyms
(2R,3R)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-5-methoxy-2,3-dihydro-9H-[1,4]dioxino[2,3-h]chromen-9-one
Cleomiscosin A
class Information
charge
0
formula
C20H18O8
has_dbxref
- CAS:76948-72-6
- KEGG:C09922
- KNApSAcK:C00002984
- PMID:17366738
- PMID:18651599
- PMID:18800331
- PMID:19720117
- PMID:20813432
- PMID:21854171
- Reaxys:6773036
has_obo_namespace
chebi_ontology
inchi
InChI=1S/C20H18O8/c1-24-13-7-10(3-5-12(13)22)17-15(9-21)26-20-18-11(4-6-16(23)27-18)8-14(25-2)19(20)28-17/h3-8,15,17,21-22H,9H2,1-2H3/t15-,17-/m1/s1
inchikey
OCBGWPJNUZMLCA-NVXWUHKLSA-N
in_subset
mass
386.35210
monoisotopicmass
386.10017
smiles
[H][C@@]1(Oc2c(OC)cc3ccc(=O)oc3c2O[C@@H]1CO)c1ccc(O)c(OC)c1