Glycoside
...
GD136201

Name:
4,4',5,7,10-pentahydroxy-1,3,10',12'-tetramethyl-6'-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1,3,4,9-tetrahydro-11',14',16'-trioxaspiro[naphtho[2,3-c]pyran-6,15'-tetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadecane]-2'(7'),3',5',9'(17')-tetraene-8',9-dione

Formula:
C36H38O17

Smiles:
CC1OC(C)C2OC3(OC4C2=C1C(=O)c1c(OC2OC(CO)C(O)C(O)C2O)cc(O)cc14)C(O)=CC(=O)c1c(O)c2c(c(O)c13)C(O)C(C)OC2C

Aglycone:
CC1OC(C)C2OC3(OC4C2=C1C(=O)c1c(O)cc(O)cc14)C(O)=CC(=O)c1c(O)c2c(c(O)c13)C(O)C(C)OC2C

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

Other Identifiers

Properties
HBA: 17 RingCount: 8
HBD: 9 FractionCSP3: 0.5
AlogP: 0.74 Num_rotatable_bonds: 3
MolWt: 742.68 Num_heavy_atoms: 53
TPSA: 271.59 NumAromaticRings: 2

Unique Aglycone
AD55051
Formula: C30H28O12

Smiles:
CC1OC(C)C2OC3(OC4C2=C1C(=O)c1c(O)cc(O)cc14)C(O)=CC(=O)c1c(O)c2c(c(O)c13)C(O)C(C)OC2C
HBA: 12 RingCount: 7
HBD: 6 FractionCSP3: 0.4
AlogP: 3.27 Num_rotatable_bonds: 0
MolWt: 580.54 Num_heavy_atoms: 42
TPSA: 192.44 NumAromaticRings: 2

Sugarmoiety
SD00003

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