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Castanin

PropertiesImageOccurences in reactions
MNX_IDMNXM120330Image of MNXM120330
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC34H24O22
charge0
mass784.07592
referencehmdb:HMDB0039245
InChIKeyULOZLJUAARUDHM-UHFFFAOYSA-N
InChIInChI=1S/C34H24O22/c35-9-2-6-12(21(42)19(9)40)5-1-8(18(39)26(47)17(5)38)31(49)53-4-11(37)28(54-32(6)50)30-29-25(46)16-15(34(52)55-29)14(23(44)27(48)24(16)45)13-7(33(51)56-30)3-10(36)20(41)22(13)43/h1-3,11,25,28-30,35-48H,4H2
SMILESO=C1OCC(O)C(C2OC(=O)c3cc(O)c(O)c(O)c3-c3c(O)c(O)c(O)c4c3C(=O)OC2C4O)OC(=O)c2cc(O)c(O)c(O)c2-c2cc1c(O)c(O)c2O
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0039245 Castanin
14-{3,4,5,11,16,17,18-heptahydroxy-8,14-dioxo-9,13-dioxatricyclo[13.3.1.0²,⁷]nonadeca-1(18),2,4,6,15(19),16-hexaen-10-yl}-2,3,4,7,8,9,19-heptahydroxy-13,16-dioxatetracyclo[13.3.1.0⁵,¹⁸.0⁶,¹¹]nonadeca-1(18),2,4,6,8,10-hexaene-12,17-dione
2-BDBP
2-BDBP-BF4
2-Benzylamino-4-methyl-7-diethylaminobenzopyrylium
5-Desgalloylstachyurin
Tomentosin?
hmdb:HMDB39245 secondary/obsolete/fantasy identifier