Glycoside
...
GD128363

Name:
None

Formula:
C29H38O18N5P

Smiles:
CC(OP(=O)(O)OCC(O)C(O)C(O)CN1c2cc(O)ccc2Cc2c(O)nc(O)nc21)C(O)=NC(CCC(O)=NC(CCC(=O)O)C(=O)O)C(=O)O

Aglycone:
CC(O[PH](=O)O)C(O)=NC(CCC(O)=NC(CCC(=O)O)C(=O)O)C(=O)O.CN1c2cc(O)ccc2Cc2c(O)nc(O)nc21

Sugarmoiety:
OOCC(O)C(O)C(O)O

Other Identifiers

Properties
HBA: 23 RingCount: 3
HBD: 12 FractionCSP3: 0.48
AlogP: -0.3 Num_rotatable_bonds: 20
MolWt: 775.61 Num_heavy_atoms: 53
TPSA: 383.24 NumAromaticRings: 2

Unique Aglycone
AD49828
Formula: C13H21O11N2P

Smiles:
CC(O[PH](=O)O)C(O)=NC(CCC(O)=NC(CCC(=O)O)C(=O)O)C(=O)O
HBA: 13 RingCount: 0
HBD: 6 FractionCSP3: 0.62
AlogP: 0.24 Num_rotatable_bonds: 13
MolWt: 412.29 Num_heavy_atoms: 27
TPSA: 223.61 NumAromaticRings: 0
AD51993
Formula: C12H11O3N3

Smiles:
CN1c2cc(O)ccc2Cc2c(O)nc(O)nc21
HBA: 6 RingCount: 3
HBD: 3 FractionCSP3: 0.17
AlogP: 1.27 Num_rotatable_bonds: 0
MolWt: 245.24 Num_heavy_atoms: 18
TPSA: 89.71 NumAromaticRings: 2

Sugarmoiety
SD01759

OOCC(O)C(O)C(O)O