NSC-170987
FEATURES
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NAMES
  • NSC-170987
SMILES
COc1cc(O)c(C2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3O2)cc1O
InChI
InChI=1S/C28H34O16/c1-9-21(33)23(35)25(37)27(41-9)40-8-19-22(34)24(36)26(38)28(44-19)42-10-3-14(31)20-15(32)7-16(43-18(20)4-10)11-5-13(30)17(39-2)6-12(11)29/h3-6,9,16,19,21-31,33-38H,7-8H2,1-2H3/t9-,16?,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1
MOLECULAR FORMULA
C28H34O16
CROSS REFERENCES
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NSC-170987
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight626.18
AlogP-1.45
HBond donors9
HBond acceptors16
Atoms78
Contains toxicophoreYes
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by NSC-170987.