Search MNXref
SystemsX.ch
The Swiss Initiative in Systems Biology
 Feedback

25-Cinnamoyl-vulgaroside

PropertiesImageOccurences in reactions
MNX_IDMNXM117078Image of MNXM117078
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC34H46O7
charge0
mass566.32435
referencechebi:176068
InChIKeySXPHINZZVYORPV-VAWYXSNFSA-N
InChIInChI=1S/C34H46O7/c1-31(2)15-8-16-32(3)25(31)13-17-33(4)26(32)14-18-34(39,21-35)27(33)20-24(36)23-19-29(38)41-30(23)40-28(37)12-11-22-9-6-5-7-10-22/h5-7,9-12,19,24-27,30,35-36,39H,8,13-18,20-21H2,1-4H3/b12-11+
SMILESCC1(C)CCCC2(C)C1CCC1(C)C(CC(O)C3=CC(=O)OC3OC(=O)/C=C/c3ccccc3)C(O)(CO)CCC21
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:176068
chebi:176068 		25-Cinnamoyl-vulgaroside
[3-[1-hydroxy-2-[2-hydroxy-2-(hydroxymethyl)-4b,8,8,10a-tetramethyl-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl]ethyl]-5-oxo-2H-uran-2-yl] (E)-3-phenylprop-2-enoate
hmdb:HMDB0041367 25-Cinnamoyl-vulgaroside
3-{1-hydroxy-2-[2-hydroxy-2-(hydroxymethyl)-4b,8,8,10a-tetramethyl-decahydrophenanthren-1-yl]ethyl}-5-oxo-2H-furan-2-yl (2E)-3-phenylprop-2-enoate
3-{1-hydroxy-2-[2-hydroxy-2-(hydroxymethyl)-4b,8,8,10a-tetramethyl-tetradecahydrophenanthren-1-yl]ethyl}-5-oxo-2,5-dihydrofuran-2-yl (2E)-3-phenylprop-2-enoate
3-{1-hydroxy-2-[2-hydroxy-2-(hydroxymethyl)-4b,8,8,10a-tetramethyl-tetradecahydrophenanthren-1-yl]ethyl}-5-oxo-2,5-dihydrofuran-2-yl (2E)-3-phenylprop-2-enoic acid
hmdb:HMDB41367 secondary/obsolete/fantasy identifier