Glycoside
GD116753
Name:
2-{[2-hydroxy-2,6,10,14,19,23-hexamethyl-25-(2,6,6-trimethylcyclohex-1-en-1-yl)pentacosa-4,6,8,10,12,14,16,18,20,22,24-undecaen-3-yl]oxy}-3,5-dimethoxy-6-methyloxan-4-olFormula:
C48H70O6Smiles:
COC1C(C)OC(OC(C=CC(C)=CC=CC(C)=CC=CC(C)=CC=CC=C(C)C=CC=C(C)C=CC2=C(C)CCCC2(C)C)C(C)(C)O)C(OC)C1OAglycone:
CC(C=CC=C(C)C=CC=C(C)C=CC(O)C(C)(C)O)=CC=CC=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)CSugarmoiety:
COC1C(C)OC(O)C(OC)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 10.87 | Num_rotatable_bonds: | 17 |
| MolWt: | 743.08 | Num_heavy_atoms: | 54 |
| TPSA: | 77.38 | NumAromaticRings: | 0 |
Unique Aglycone
AD46427
Formula: C40H56O2
Smiles:
CC(C=CC=C(C)C=CC=C(C)C=CC(O)C(C)(C)O)=CC=CC=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)C| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 10.71 | Num_rotatable_bonds: | 13 |
| MolWt: | 568.89 | Num_heavy_atoms: | 42 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
