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Nephelioside Iv
FEATURES
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NAMES
  • nephelioside IV
SMILES
CO[C@@H]1C[C@H]2C(C)(C)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[C@@H]4OC[C@H](O)[C@H](O)[C@H]4O)[C@H]3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]2(C)[C@H]2CC=C3[C@@H]4CC(C)(C)CC[C@]4(CO)CC[C@@]3(C)[C@]12C
InChI
InChI=1S/C48H80O17/c1-43(2)13-15-48(22-51)16-14-46(6)23(24(48)18-43)9-10-28-45(5)12-11-30(44(3,4)29(45)17-31(59-8)47(28,46)7)63-42-39(65-41-37(58)35(56)33(54)26(19-49)61-41)38(34(55)27(20-50)62-42)64-40-36(57)32(53)25(52)21-60-40/h9,24-42,49-58H,10-22H2,1-8H3/t24-,25-,26+,27+,28+,29-,30-,31+,32-,33+,34+,35-,36+,37+,38-,39+,40-,41-,42-,45+,46+,47-,48+/m0/s1
MOLECULAR FORMULA
C48H80O17
CROSS REFERENCES
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Nephelioside Iv

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 928.54
AlogP 0.88
HBond donors 10
HBond acceptors 17
Atoms 145
Contains toxicophore No
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Nephelioside Iv.