Glycoside
GD135961
Name:
35-Amino-3Î’-Methylbacteriohop-11-Ene-30,31,32,33,34-PentolFormula:
C36H63O5NSmiles:
CC(C(O)C(O)C(O)C(O)C(O)CN)C1CCC2(C)C1CCC1(C)C2C=CC2C3(C)CCC(C)C(C)(C)C3CCC21CAglycone:
CCC1CCC2(C)C1CCC1(C)C2C=CC2C3(C)CCC(C)C(C)(C)C3CCC21CSugarmoiety:
NCC(O)C(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.94 |
| AlogP: | 4.9 | Num_rotatable_bonds: | 7 |
| MolWt: | 589.9 | Num_heavy_atoms: | 42 |
| TPSA: | 127.17 | NumAromaticRings: | 0 |
Unique Aglycone
AD54963
Formula: C30H50
Smiles:
CCC1CCC2(C)C1CCC1(C)C2C=CC2C3(C)CCC(C)C(C)(C)C3CCC21C| HBA: | 0 | RingCount: | 5 |
| HBD: | 0 | FractionCSP3: | 0.93 |
| AlogP: | 8.91 | Num_rotatable_bonds: | 1 |
| MolWt: | 410.73 | Num_heavy_atoms: | 30 |
| TPSA: | 0.0 | NumAromaticRings: | 0 |
