Search MNXref
 Feedback

(-)-(3S)-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)-(6E)-6-hepten-3-ol

PropertiesImage
MNX_IDMNXM100819 Image of MNXM100819
referencechebi:70688
formulaC19H22O4
global charge0
mol weight314.381
InChIKeyRECNHCLFPNYLCU-VQRJYJFOSA-N
InChIInChI=1S/C19H22O4/c20-16(11-7-15-8-12-18(22)19(23)13-15)4-2-1-3-14-5-9-17(21)10-6-14/h1,3,5-6,8-10,12-13,16,20-23H,2,4,7,11H2/b3-1+/t16-/m0/s1
SMILESOC1=CC=C(/C=C/CC[C@H](O)CCC2=CC(O)=C(O)C=C2)C=C1
MNX internals
InChI (mnx)InChI=1/C19H22O4/c20-16(11-7-15-8-12-18(22)19(23)13-15)4-2-1-3-14-5-9-17(21)10-6-14/h1,3,5-6,8-10,12-13,16,20-23H,2,4,7,11H2/b3-1+/t16-/m0/s1 Image of MNXM100819
SMILES (mnx)[CH:1](\[CH2:2][CH2:4][C@@H:16]([CH2:11][CH2:7][C:15]1=[CH:13][C:19]([OH:23])=[C:18]([OH:22])[CH:12]=[CH:8]1)[OH:20])=[CH:3]/[C:14]1=[CH:6][CH:10]=[C:17]([OH:21])[CH:9]=[CH:5]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:70688
chebi:70688
RECNHCLFPNYLCU-VQRJYJFOSA-N
(-)-(3S)-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)-(6E)-6-hepten-3-ol
4-[(3S,6E)-3-hydroxy-7-(4-hydroxyphenyl)hept-6-en-1-yl]benzene-1,2-diol