Glycoside
...
GD037395

Name:
None

Formula:
C46H82O22N6

Smiles:
CC(=O)N[C@H]1[C@H](O)[C@@H](O)[C@@H](CO)O[C@H]1OCCCNCCC(=O)N(CCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(C)=O)CCC(=O)N(CCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(C)=O)CCC(=O)OC(C)(C)C

Aglycone:
CC(C)(C)OC(=O)CCN(CCCO)C(=O)CCN(CCCO)C(=O)CCNCCCO

Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1O.CC(=O)NC1C(O)OC(CO)C(O)C1O.CC(=O)NC1C(O)OC(CO)C(O)C1O

Other Identifiers

Properties
HBA: 28 RingCount: 3
HBD: 13 FractionCSP3: 0.87
AlogP: -6.2 Num_rotatable_bonds: 30
MolWt: 1071.18 Num_heavy_atoms: 74
TPSA: 403.7 NumAromaticRings: 0

Unique Aglycone
AD23561
Formula: C22H43O7N3

Smiles:
CC(C)(C)OC(=O)CCN(CCCO)C(=O)CCN(CCCO)C(=O)CCNCCCO
HBA: 10 RingCount: 0
HBD: 4 FractionCSP3: 0.86
AlogP: -0.11 Num_rotatable_bonds: 18
MolWt: 461.6 Num_heavy_atoms: 32
TPSA: 139.64 NumAromaticRings: 0

Sugarmoiety
SD00390

CC(=O)NC1C(O)OC(CO)C(O)C1O.CC(=O)NC1C(O)OC(CO)C(O)C1O.CC(=O)NC1C(O)OC(CO)C(O)C1O