Glycoside
...
GD010483

Name:
RUBIYUNNANIN G

Formula:
C45H56O14N6

Smiles:
C[C@@H]1NC(=O)[C@@H]2Cc3ccc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)c(c3)Oc3ccc(cc3)C[C@H](C(=O)N2C)N(C)C(=O)[C@H](C)NC(=O)[C@H](Cc2ccc(O)cc2)N(C)C(=O)[C@H](C)NC1=O

Aglycone:
CC1NC(=O)C2Cc3ccc(O)c(c3)Oc3ccc(cc3)CC(C(=O)N2C)N(C)C(=O)C(C)NC(=O)C(Cc2ccc(O)cc2)N(C)C(=O)C(C)NC1=O

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 20 RingCount: 7
HBD: 8 FractionCSP3: 0.47
AlogP: -1.29 Num_rotatable_bonds: 5
MolWt: 904.97 Num_heavy_atoms: 65
TPSA: 277.07 NumAromaticRings: 3

Unique Aglycone
AD08090
Formula: C39H46O9N6

Smiles:
CC1NC(=O)C2Cc3ccc(O)c(c3)Oc3ccc(cc3)CC(C(=O)N2C)N(C)C(=O)C(C)NC(=O)C(Cc2ccc(O)cc2)N(C)C(=O)C(C)NC1=O
HBA: 15 RingCount: 6
HBD: 5 FractionCSP3: 0.38
AlogP: 1.24 Num_rotatable_bonds: 2
MolWt: 742.83 Num_heavy_atoms: 54
TPSA: 197.92 NumAromaticRings: 3

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O