Glycoside

GD003546
Name:
NoneFormula:
C38H63O17N10PSmiles:
Cc1cn([C@@H]2C[C@@H](O)[C@H](COP(=O)(O)O[C@H]3C[C@@H](n4cc(C)c(=O)[nH]c4=O)O[C@H]3C(=O)NCCCCCCN[C@H]3[C@H](O[C@@H]4O[C@H](CN)[C@H](O)[C@H](O)[C@H]4N)[C@@H](N)C[C@@H](N)[C@H]3O)O2)c(=O)[nH]c1=OAglycone:
Cc1cn(C2CC(O)C(COP(=O)(O)OC3CC(n4cc(C)c(=O)[nH]c4=O)OC3C(=O)NCCCCCCNC3C(O)C(N)CC(N)C3O)O2)c(=O)[nH]c1=OSugarmoiety:
NCC1OC(O)C(N)C(O)C1OOther Identifiers
Properties
HBA: | 27 | RingCount: | 6 |
HBD: | 17 | FractionCSP3: | 0.76 |
AlogP: | -5.69 | Num_rotatable_bonds: | 19 |
MolWt: | 962.95 | Num_heavy_atoms: | 66 |
TPSA: | 428.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD03213
Formula: C32H51O14N8P
Smiles:
Cc1cn(C2CC(O)C(COP(=O)(O)OC3CC(n4cc(C)c(=O)[nH]c4=O)OC3C(=O)NCCCCCCNC3C(O)C(N)CC(N)C3O)O2)c(=O)[nH]c1=OHBA: | 22 | RingCount: | 5 |
HBD: | 12 | FractionCSP3: | 0.72 |
AlogP: | -3.44 | Num_rotatable_bonds: | 16 |
MolWt: | 802.78 | Num_heavy_atoms: | 55 |
TPSA: | 337.8 | NumAromaticRings: | 2 |