Feedback

12'-Apo-b-carotene-3,12'-diol

Properties

Image

Occurences in reactions

MNX_ID

MNXM116122

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₂₅H₃₆O₂

charge

mass

368.27153

reference

chebi:143064

InChIKey

XVQDCCGQSOTQBN-RXCALXPUSA-N

InChI

InChI=1S/C25H36O2/c1-19(10-7-8-11-21(3)18-26)12-9-13-20(2)14-15-24-22(4)16-23(27)17-25(24,5)6/h7-15,23,26-27H,16-18H2,1-6H3/b8-7+,12-9+,15-14+,19-10+,20-13-,21-11-

SMILES

CC1=C(/C=C/C(C)=C\C=C\C(C)=C\C=C\C=C(\C)CO)C(C)(C)CC(O)C1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:143064 chebi:143064	12'-Apo-b-carotene-3,12'-diol
hmdb:HMDB0036054	12'-Apo-b-carotene-3,12'-diol 4-[(1E,3Z,5E,7E,9E,11Z)-13-hydroxy-3,7,12-trimethyltrideca-1,3,5,7,9,11-hexaen-1-yl]-3,5,5-trimethylcyclohex-3-en-1-ol
hmdb:HMDB36054	secondary/obsolete/fantasy identifier