Glycoside
...
GD146559

Name:
cordylasin a

Formula:
C45H60O28

Smiles:
CC1OC(Oc2cc(O)c3c(=O)c(OC4OC(COC5OC(C)C(O)C(OC6OC(C)C(O)C(O)C6O)C5O)C(O)C(O)C4OC4OC(C)C(O)C(O)C4O)c(-c4ccc(O)c(O)c4)oc3c2)C(O)C(O)C1O

Aglycone:
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12

Sugarmoiety:
CC1OC(O)C(O)C(O)C1O.CC1OC(OC2C(O)OC(COC3OC(C)C(O)C(OC4OC(C)C(O)C(O)C4O)C3O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 28 RingCount: 8
HBD: 16 FractionCSP3: 0.67
AlogP: -5.48 Num_rotatable_bonds: 12
MolWt: 1048.95 Num_heavy_atoms: 73
TPSA: 446.19 NumAromaticRings: 3

Unique Aglycone
AD00377
Formula: C15H10O7

Smiles:
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
HBA: 7 RingCount: 3
HBD: 5 FractionCSP3: 0.0
AlogP: 1.99 Num_rotatable_bonds: 1
MolWt: 302.24 Num_heavy_atoms: 22
TPSA: 131.36 NumAromaticRings: 3

Sugarmoiety
SD09345

CC1OC(O)C(O)C(O)C1O.CC1OC(OC2C(O)OC(COC3OC(C)C(O)C(OC4OC(C)C(O)C(O)C4O)C3O)C(O)C2O)C(O)C(O)C1O