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capsimine-3-O-beta-d-glucoside
FEATURES
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NAMES
  • capsimine-3-O-beta-d-glucoside
SMILES
C[C@@H](C1[C@H](O)C[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C)[C@H]1CC[C@@H](C)CN1
InChI
InChI=1S/C33H55NO7/c1-17-5-8-24(34-15-17)18(2)27-25(36)14-23-21-7-6-19-13-20(9-11-32(19,3)22(21)10-12-33(23,27)4)40-31-30(39)29(38)28(37)26(16-35)41-31/h6,17-18,20-31,34-39H,5,7-16H2,1-4H3/t17-,18-,20+,21-,22+,23+,24-,25-,26-,27?,28-,29+,30-,31-,32+,33+/m1/s1
MOLECULAR FORMULA
C33H55NO7
CROSS REFERENCES
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capsimine-3-O-beta-d-glucoside

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 577.40
AlogP 2.75
HBond donors 6
HBond acceptors 8
Atoms 96
Contains toxicophore Yes
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by capsimine-3-O-beta-d-glucoside.