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3,4,15-triacetoxyscirpenol

PropertiesImageOccurences in reactions
MNX_IDMNXM163663Image of MNXM163663
#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 0
formulaC21H28O8
charge0
mass408.17842
referencemetacycM:CPD-18413
InChIKeyYWQOKOBRSAAKTG-AMTHWPQPSA-N
InChIInChI=1S/C21H28O8/c1-11-6-7-20(9-25-12(2)22)15(8-11)29-18-16(27-13(3)23)17(28-14(4)24)19(20,5)21(18)10-26-21/h8,15-18H,6-7,9-10H2,1-5H3/t15-,16-,17-,18-,19-,20-,21?/m1/s1
SMILESCC(=O)OC[C@]12CCC(C)=C[C@H]1O[C@@H]1[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@]2(C)C12CO2
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
metacyc.compound:CPD-18413
metacycM:CPD-18413
seed.compound:cpd31774
seedM:cpd31774
3,4,15-triacetoxyscirpenol
acetylanguidine
seedM:M_cpd31774 secondary/obsolete/fantasy identifier