Glycoside
GD027829
Name:
NoneFormula:
C34H63O12N9Smiles:
CC1OC(OCCCCCCNC(=O)[C@H](CCCCNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)N)C(O)C(O)C1OAglycone:
CC(N)C(=O)NC(CCC(N)=O)C(=O)NCCCCC(NC(=O)C(CCC(N)=O)NC(=O)C(C)N)C(=O)NCCCCCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 21 | RingCount: | 1 |
| HBD: | 16 | FractionCSP3: | 0.79 |
| AlogP: | -4.53 | Num_rotatable_bonds: | 27 |
| MolWt: | 789.93 | Num_heavy_atoms: | 55 |
| TPSA: | 362.87 | NumAromaticRings: | 0 |
Unique Aglycone
AD18246
Formula: C28H53O8N9
Smiles:
CC(N)C(=O)NC(CCC(N)=O)C(=O)NCCCCC(NC(=O)C(CCC(N)=O)NC(=O)C(C)N)C(=O)NCCCCCCO| HBA: | 17 | RingCount: | 0 |
| HBD: | 14 | FractionCSP3: | 0.75 |
| AlogP: | -3.38 | Num_rotatable_bonds: | 25 |
| MolWt: | 643.79 | Num_heavy_atoms: | 45 |
| TPSA: | 303.95 | NumAromaticRings: | 0 |
