torososide B

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 1
Total Number of Articles : 1
PubChem 9988405
Molecular Formula

C40H52O25

SMILES

CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)O)O)O)O)O)O)OC

InChI

InChI=1S/C40H52O25/c1-11-3-13-21(15(43)4-11)28(49)22-14(23(13)44)5-12(57-2)6-16(22)60-39-33(54)30(51)25(46)19(63-39)10-59-38-35(56)36(27(48)18(8-42)62-38)65-40-34(55)31(52)26(47)20(64-40)9-58-37-32(53)29(50)24(45)17(7-41)61-37/h3-6,17-20,24-27,29-43,45-48,50-56H,7-10H2,1-2H3/t17-,18-,19-,20-,24-,25-,26-,27-,29+,30+,31+,32-,33-,34-,35-,36+,37-,38-,39-,40+/m1/s1

synonyms
  • Torososide B
  • CHEBI:66257
  • Q27134801
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Properties
Property Value
MW 932.8 g/mol
HBD 14
HBA 25
Rotatable Bond Count 13
Exact Mass 932.27976714 g/mol
Monoisotopic Mass 932.27976714 g/mol
Heavy Atom Count 65
Isotope Atom Count 0
Atom Stereo Count 20
Covalent Unit Count 1
Complexity 1600
xlogp -4.6
Topological Polar Surface Area 400