Glycoside

GD127439
Name:
10-hydroxy-6,9,10,23-tetramethyl-20-[(3,4,5,6-tetrahydroxyoxan-2-yl)oxy]-4-azahexacyclo[12.11.0.0²,¹¹.0â´,â¹.0¹âµ,²â´.0¹â¸,²³]pentacosan-17-oneFormula:
C33H53O8NSmiles:
CC1CCC2(C)N(C1)CC1C3CC4C(CC(=O)C5CC(OC6OC(O)C(O)C(O)C6O)CCC54C)C3CCC1C2(C)OAglycone:
CC1CCC2(C)N(C1)CC1C3CC4C(CC(=O)C5CC(O)CCC54C)C3CCC1C2(C)OSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 9 | RingCount: | 7 |
HBD: | 5 | FractionCSP3: | 0.97 |
AlogP: | 2.06 | Num_rotatable_bonds: | 2 |
MolWt: | 591.79 | Num_heavy_atoms: | 42 |
TPSA: | 139.92 | NumAromaticRings: | 0 |
Unique Aglycone
AD51607
Formula: C28H45O3N
Smiles:
CC1CCC2(C)N(C1)CC1C3CC4C(CC(=O)C5CC(O)CCC54C)C3CCC1C2(C)OHBA: | 4 | RingCount: | 6 |
HBD: | 2 | FractionCSP3: | 0.96 |
AlogP: | 4.28 | Num_rotatable_bonds: | 0 |
MolWt: | 443.67 | Num_heavy_atoms: | 32 |
TPSA: | 60.77 | NumAromaticRings: | 0 |