(-)-vestitol
Chemical Formula:
C16H16O4
Molecular Weight:
272.3 Daltons
Monoisotopic Mass:
272.104859002 Daltons
SMILES:
COC1(C=C(C(=CC=1)C3(CC2(C(=CC(=CC=2)O)OC3)))O)
InChI:
1S/C16H16O4/c1-19-13-4-5-14(15(18)8-13)11-6-10-2-3-12(17)7-16(10)20-9-11/h2-5,7-8,11,17-18H,6,9H2,1H3/t11-/m1/s1
InChIKey:
Synonyms
- (3S)-3-(2-hydroxy-4-methoxyphenyl)chroman-7-ol
Databases
MetaCyc:
CPD-9366
MetaboLights:
MTBLC9971
ChEBI:
9971
ChemSpider:
154266
PubChem (CID):
177149
KEGG:
C10540