Glycoside
...
GD153746

Name:
21-chloro-3-[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]-3,13,23-triazahexacyclo[14.7.0.0²,¹⁰.0⁴,⁹.0¹¹,¹⁵.0¹⁷,²²]tricosa-1(16),2(10),4,6,8,11(15),17(22),18,20-nonaene-12,14-dione

Formula:
C28H22O7N3Cl

Smiles:
COC1C(CO)OC(n2c3ccccc3c3c4c(c5c6cccc(Cl)c6[nH]c5c32)C(O)=NC4=O)C(O)C1O

Aglycone:
O=C1N=C(O)c2c1c1c3ccccc3[nH]c1c1[nH]c3c(Cl)cccc3c21

Sugarmoiety:
COC1C(CO)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 10 RingCount: 7
HBD: 5 FractionCSP3: 0.26
AlogP: 3.17 Num_rotatable_bonds: 3
MolWt: 535.94 Num_heavy_atoms: 38
TPSA: 149.53 NumAromaticRings: 5

Unique Aglycone
AD61118
Formula: C21H10O2N3Cl

Smiles:
O=C1N=C(O)c2c1c1c3ccccc3[nH]c1c1[nH]c3c(Cl)cccc3c21
HBA: 5 RingCount: 6
HBD: 3 FractionCSP3: 0.0
AlogP: 5.07 Num_rotatable_bonds: 0
MolWt: 359.77 Num_heavy_atoms: 26
TPSA: 81.24 NumAromaticRings: 5

Sugarmoiety
SD00246

COC1C(CO)OC(O)C(O)C1O