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thiomarinol C

PropertiesImageOccurences in reactions
MNX_IDMNXM1100906Image of MNXM1100906
#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
formulaC36H56N2O8S2
charge0
mass708.34781
referenceseedM:cpd35607
InChIKeyWJBXFRGLYZXBML-UMANLCEBSA-N
InChIInChI=1S/C36H56N2O8S2/c1-24(20-29-34(43)33(42)27(22-46-29)17-15-16-25(2)26(3)39)21-31(41)45-19-14-12-10-8-6-4-5-7-9-11-13-18-30(40)38-32-35-28(23-47-48-35)37-36(32)44/h15-16,21,23,25-27,29,33-34,39,42-43H,4-14,17-20,22H2,1-3H3,(H,37,44)(H,38,40)/b16-15+,24-21+/t25-,26+,27+,29+,33-,34+/m1/s1
SMILESC/C(=C\C(=O)OCCCCCCCCCCCCCC(=O)Nc1c2sscc-2[nH]c1=O)C[C@@H]1OC[C@H](C/C=C/[C@@H](C)[C@H](C)O)[C@@H](O)[C@H]1O
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
seed.compound:cpd35607
seedM:cpd35607
thiomarinol C
seedM:M_cpd35607 secondary/obsolete/fantasy identifier