Glycoside
GD155140
Name:
n'-hydroxy-n-{5-[hydroxy(4-{[5-(n-hydroxyacetamido)pentyl]carbamoyl}but-1-en-2-yl)amino]pentyl}-n'-[5-({[(3s,4r,5r)-2,3,4,5-tetrahydroxyoxan-2-yl]methyl}amino)pentyl]butanediamideFormula:
C32H60O12N6Smiles:
C=C(CCC(O)=NCCCCCN(O)C(C)=O)N(O)CCCCCN=C(O)CCC(=O)N(O)CCCCCNCC1(O)OCC(O)C(O)C1OAglycone:
C=C(CCC(O)=NCCCCCN(O)C(C)=O)N(O)CCCCCN=C(O)CCC(=O)N(O)CCCCCNCSugarmoiety:
OC1COC(O)(O)C(O)C1OOther Identifiers
Properties
| HBA: | 18 | RingCount: | 1 |
| HBD: | 10 | FractionCSP3: | 0.81 |
| AlogP: | 1.02 | Num_rotatable_bonds: | 27 |
| MolWt: | 720.86 | Num_heavy_atoms: | 50 |
| TPSA: | 271.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD61555
Formula: C27H52O7N6
Smiles:
C=C(CCC(O)=NCCCCCN(O)C(C)=O)N(O)CCCCCN=C(O)CCC(=O)N(O)CCCCCNC| HBA: | 13 | RingCount: | 0 |
| HBD: | 6 | FractionCSP3: | 0.78 |
| AlogP: | 3.85 | Num_rotatable_bonds: | 25 |
| MolWt: | 572.75 | Num_heavy_atoms: | 40 |
| TPSA: | 181.76 | NumAromaticRings: | 0 |
