Glycoside
...
GD153070

Name:
5,12,21,30-tetrahydroxy-9,11,27,29-tetramethyl-23-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,10,17,28-tetraoxaheptacyclo[16.12.0.0¹,²⁶.0³,¹⁶.0⁶,¹⁵.0⁸,¹³.0¹⁹,²⁴]triaconta-3,5,8(13),15,19(24),20,22-heptaene-7,14,25-trione

Formula:
C36H38O17

Smiles:
CC1OC(C)C(O)C2=C1C(=O)c1c(O)cc3c(c1C2=O)OC1c2cc(O)cc(OC4OC(CO)C(O)C(O)C4O)c2C(=O)C2C(C)OC(C)C(O)C12O3

Aglycone:
CC1OC(C)C(O)C2=C1C(=O)c1c(O)cc3c(c1C2=O)OC1c2cc(O)cc(O)c2C(=O)C2C(C)OC(C)C(O)C12O3

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

Other Identifiers

Properties
HBA: 17 RingCount: 8
HBD: 8 FractionCSP3: 0.53
AlogP: -0.65 Num_rotatable_bonds: 3
MolWt: 742.68 Num_heavy_atoms: 53
TPSA: 268.43 NumAromaticRings: 2

Unique Aglycone
AD60904
Formula: C30H28O12

Smiles:
CC1OC(C)C(O)C2=C1C(=O)c1c(O)cc3c(c1C2=O)OC1c2cc(O)cc(O)c2C(=O)C2C(C)OC(C)C(O)C12O3
HBA: 12 RingCount: 7
HBD: 5 FractionCSP3: 0.43
AlogP: 1.88 Num_rotatable_bonds: 0
MolWt: 580.54 Num_heavy_atoms: 42
TPSA: 189.28 NumAromaticRings: 2

Sugarmoiety
SD00003

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