Repanduline
Molecular Formula:
C
37
H
36
N
2
O
7
InChI:
InChI=1/C37H36N2O7/c1-38-10-8-23-16-29-30-18-26(23)27(38)12-21-4-6-25(7-5-21)45-32-15-22(14-31-35(32)44-20-43-31)13-28-34-24(9-11-39(28)2)17-33(41-3)36(40)37(34,46-30)19-42-29/h4-7,14-18,27-28H,8-13,19-20H2,1-3H3/t27-,28+,37-/m0/s1
InChIKey:
InChIKey=ZJPDWMDHODYSGY-KDQDRUBRBE
SMILES:
CN1CCC2=CC3=C4C=C2C1CC5=CC=C(C=C5)OC6=C7C(=CC(=C6)CC8C9=C(CCN8C)C=C(C(=O)C9(O4)CO3)OC)OCO7
Names:
NSC626658
Repanduline
20398-02-1
Registries:
PubChem CID 5459137
PubChem ID 8142112