Search MNXref
 Feedback

Falcarindiol 3-acetate

PropertiesImage
MNX_IDMNXM125604 Image of MNXM125604
referencehmdb:HMDB0034167
formulaC19H26O3
global charge0
mol weight302.414
InChIKeyUZDRBZORBWOTCF-SDNWHVSQSA-N
InChIInChI=1S/C19H26O3/c1-4-6-7-8-9-10-11-14-18(21)15-12-13-16-19(5-2)22-17(3)20/h5,11,14,18-19,21H,2,4,6-10H2,1,3H3/b14-11+
SMILESC=CC(C#CC#CC(O)/C=C/CCCCCCC)OC(C)=O
MNX internals
InChI (mnx)InChI=1/C19H26O3/c1-4-6-7-8-9-10-11-14-18(21)15-12-13-16-19(5-2)22-17(3)20/h5,11,14,18-19,21H,2,4,6-10H2,1,3H3/b14-11+/t18?,19? Image of MNXM125604
SMILES (mnx)[CH3:1][CH2:4][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]/[CH:11]=[CH:14]/[CH:18]([C:15]#[C:12][C:13]#[C:16][CH:19]([CH:5]=[CH2:2])[O:22][C:17]([CH3:3])=[O:20])[OH:21]
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
hmdb:HMDB0034167
UZDRBZORBWOTCF-SDNWHVSQSA-N
Falcarindiol 3-acetate
(9E)-8-Hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl acetic acid
(9E)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl acetate
Falcarindiol 3-acetic acid

hmdb:HMDB34167
secondary/obsolete/fantasy identifier