Glycoside
GD151744
Name:
Obtusolactam-20(R)-O-[Beta-Thevetopyranosyl-(1-4)-Beta-Cymaropyranoside]Formula:
C38H61O11NSmiles:
COC1CC(OC(C)C2(O)C3N=C(O)CC3(C)C3C4CC=C5CC(O)CCC5(C)C4CCC32C)OC(C)C1OC1OC(C)C(O)C(OC)C1OAglycone:
CC(O)C1(O)C2N=C(O)CC2(C)C2C3CC=C4CC(O)CCC4(C)C3CCC21CSugarmoiety:
COC1CC(O)OC(C)C1OC1OC(C)C(O)C(OC)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 7 |
| HBD: | 5 | FractionCSP3: | 0.92 |
| AlogP: | 3.42 | Num_rotatable_bonds: | 7 |
| MolWt: | 707.9 | Num_heavy_atoms: | 50 |
| TPSA: | 168.89 | NumAromaticRings: | 0 |
Unique Aglycone
AD49020
Formula: C24H37O4N
Smiles:
CC(O)C1(O)C2N=C(O)CC2(C)C2C3CC=C4CC(O)CCC4(C)C3CCC21C| HBA: | 5 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.88 |
| AlogP: | 3.38 | Num_rotatable_bonds: | 1 |
| MolWt: | 403.56 | Num_heavy_atoms: | 29 |
| TPSA: | 93.28 | NumAromaticRings: | 0 |
