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3,4-DIHYDRO-6-HYDROXY MANZAMINE A
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NAMES
  • 3,4-DIHYDRO-6-HYDROXY MANZAMINE A
SMILES
Oc1ccc2[nH]c3c(c2c1)CCN=C3C1=C[C@@]2(O)CC/C=C\CCCCN3CC[C@@H]1[C@]1(C[C@H]4C/C=C\CCCN4[C@@H]21)C3
InChI
InChI=1S/C36H46N4O2/c41-26-12-13-31-28(21-26)27-14-17-37-32(33(27)38-31)29-23-36(42)16-8-4-1-2-5-9-18-39-20-15-30(29)35(24-39)22-25-11-7-3-6-10-19-40(25)34(35)36/h1,3-4,7,12-13,21,23,25,30,34,38,41-42H,2,5-6,8-11,14-20,22,24H2/b4-1-,7-3-/t25-,30+,34-,35+,36+/m1/s1
MOLECULAR FORMULA
C36H46N4O2
CROSS REFERENCES
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3,4-DIHYDRO-6-HYDROXY MANZAMINE A

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 566.36
AlogP 5.90
HBond donors 3
HBond acceptors 6
Atoms 88
Contains toxicophore No
Contains PAINS Yes
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 3,4-DIHYDRO-6-HYDROXY MANZAMINE A.