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gelsemiol-6'-trans-caffeoyl-1-glucoside

PropertiesImageOccurences in reactions
MNX_IDMNXM105337Image of MNXM105337
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC25H32O12
charge0
mass524.18938
referencechebi:65957
InChIKeyRLIILNKNNUJZAL-HPBWOJKHSA-N
InChIInChI=1S/C25H32O12/c1-11-6-17-20(13(8-26)24(33)36-17)14(11)9-35-25-23(32)22(31)21(30)18(37-25)10-34-19(29)5-3-12-2-4-15(27)16(28)7-12/h2-5,7,11,13-14,17-18,20-23,25-28,30-32H,6,8-10H2,1H3/b5-3+/t11-,13-,14+,17-,18+,20+,21+,22-,23+,25+/m0/s1
SMILESC[C@H]1C[C@@H]2OC(=O)[C@@H](CO)[C@@H]2[C@@H]1CO[C@@H]1O[C@H](COC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@H](O)[C@H]1O
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IdentifierDescription
CHEBI:65957
chebi:65957
gelsemiol-6'-trans-caffeoyl-1-glucoside
[(3R,3aS,4R,5S,6aS)-3-(hydroxymethyl)-5-methyl-2-oxohexahydro-2H-cyclopenta[b]furan-4-yl]methyl 6-O-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranoside