Glycoside

GD033328
Name:
OCEANAPISIDEFormula:
C35H70O8N2Smiles:
CC1[C@H](O)[C@@H](O)[C@@H](O[C@H](CCCCCCCC(=O)CCCCCCCCCCCCCC[C@H](O)[C@H](C)N)[C@H](N)CO)O[C@H]1COAglycone:
CC(N)C(O)CCCCCCCCCCCCCCC(=O)CCCCCCCC(O)C(N)COSugarmoiety:
CC1C(CO)OC(O)C(O)C1OOther Identifiers
Properties
HBA: | 10 | RingCount: | 1 |
HBD: | 9 | FractionCSP3: | 0.97 |
AlogP: | 4.24 | Num_rotatable_bonds: | 29 |
MolWt: | 646.95 | Num_heavy_atoms: | 45 |
TPSA: | 188.72 | NumAromaticRings: | 0 |
Unique Aglycone
AD13641
Formula: C28H58O4N2
Smiles:
CC(N)C(O)CCCCCCCCCCCCCCC(=O)CCCCCCCC(O)C(N)COHBA: | 6 | RingCount: | 0 |
HBD: | 7 | FractionCSP3: | 0.96 |
AlogP: | 5.14 | Num_rotatable_bonds: | 26 |
MolWt: | 486.78 | Num_heavy_atoms: | 34 |
TPSA: | 129.8 | NumAromaticRings: | 0 |