Ptilosaponoside B
FEATURES
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NAMES
  • Ptilosaponoside B
SMILES
C=C[C@H]1CC[C@H]2[C@@H]3CC[C@H]4[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](OS(=O)(=O)[O-])[C@H]5O)[C@@H](O)CC[C@]4(CO)[C@H]3CC[C@@]21C.[Na+]
InChI
InChI=1S/C27H44O11S.Na/c1-3-14-4-6-16-15-5-7-18-23(19(30)9-11-27(18,13-29)17(15)8-10-26(14,16)2)37-25-22(32)24(38-39(33,34)35)21(31)20(12-28)36-25;/h3,14-25,28-32H,1,4-13H2,2H3,(H,33,34,35);/q;+1/p-1/t14-,15-,16-,17-,18-,19-,20+,21+,22+,23+,24-,25-,26+,27-;/m0./s1
MOLECULAR FORMULA
C27H43NaO11S
CROSS REFERENCES
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Ptilosaponoside B
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight598.24
AlogP-2.55
HBond donors5
HBond acceptors11
Atoms83
Contains toxicophoreYes
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Ptilosaponoside B.