Search MNXref
 Feedback

(S)-isoflavan

PropertiesImage
MNX_IDMNXM31849 Image of MNXM31849
referencechebi:36100
formulaC15H14O
global charge0
mol weight210.276
InChIKeyNNQSGBRGJHSRFN-CQSZACIVSA-N
InChIInChI=1S/C15H14O/c1-2-6-12(7-3-1)14-10-13-8-4-5-9-15(13)16-11-14/h1-9,14H,10-11H2/t14-/m1/s1
SMILESC1=CC=C([C@H]2COC3=CC=CC=C3C2)C=C1
MNX internals
InChI (mnx)InChI=1/C15H14O/c1-2-6-12(7-3-1)14-10-13-8-4-5-9-15(13)16-11-14/h1-9,14H,10-11H2/t14-/m1/s1 Image of MNXM31849
SMILES (mnx)[CH:1]1=[CH:2][CH:6]=[C:12]([C@@H:14]2[CH2:10][C:13]3=[CH:8][CH:4]=[CH:5][CH:9]=[C:15]3[O:16][CH2:11]2)[CH:7]=[CH:3]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:36100
chebi:36100
NNQSGBRGJHSRFN-CQSZACIVSA-N
(S)-isoflavan
(3S)-3-phenylchromane