Glycoside
...
GD140341

Name:
2-hydroxy-4,5,9,9,13,20,20-heptamethyl-10-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-22-oxahexacyclo[19.2.1.0¹,¹⁸.0⁴,¹⁷.0⁵,¹⁴.0⁸,¹³]tetracos-16-en-23-one

Formula:
C36H56O9

Smiles:
CC1(C)CC2C3=CCC4C5(C)CCC(OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)CC(O)C23CC1OC3=O

Aglycone:
CC1(C)CC2C3=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CC(O)C23CC1OC3=O

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

Other Identifiers

Properties
HBA: 9 RingCount: 7
HBD: 5 FractionCSP3: 0.92
AlogP: 3.48 Num_rotatable_bonds: 3
MolWt: 632.84 Num_heavy_atoms: 45
TPSA: 145.91 NumAromaticRings: 0

Unique Aglycone
AD04468
Formula: C30H46O4

Smiles:
CC1(C)CC2C3=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CC(O)C23CC1OC3=O
HBA: 4 RingCount: 6
HBD: 2 FractionCSP3: 0.9
AlogP: 5.66 Num_rotatable_bonds: 0
MolWt: 470.69 Num_heavy_atoms: 34
TPSA: 66.76 NumAromaticRings: 0

Sugarmoiety
SD00003

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