Glycoside
...
GD157736

Name:
1-acetyl-1-hydroxy-7-({4-methoxy-5-[(4-methoxy-5-{[4-methoxy-5-({4-methoxy-5-[(4-methoxy-6-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-6-methyloxan-2-yl}oxy)-6-methyloxan-2-yl]oxy}-6-methyloxan-2-yl)oxy]-6-methyloxan-2-yl}oxy)-9a-methyl-1H,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H-cyclopenta[a]phenanthren-11-one

Formula:
C61H94O24

Smiles:
COC1CC(OC2CCC3(C)C(=CCC4C5=C(C(=O)CC43)C(O)(C(C)=O)C=C5)C2)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3CC(OC)C(OC4CC(OC)C(OC5OC(CO)C(O)C(O)C5O)C(C)O4)C(C)O3)C(C)O2)C(C)O1

Aglycone:
CC(=O)C1(O)C=CC2=C1C(=O)CC1C2CC=C2CC(O)CCC21C

Sugarmoiety:
COC1CC(O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3CC(OC)C(OC4CC(OC)C(OC5OC(CO)C(O)C(O)C5O)C(C)O4)C(C)O3)C(C)O2)C(C)O1

Other Identifiers

Properties
HBA: 24 RingCount: 10
HBD: 5 FractionCSP3: 0.87
AlogP: 2.76 Num_rotatable_bonds: 19
MolWt: 1211.4 Num_heavy_atoms: 85
TPSA: 292.2 NumAromaticRings: 0

Unique Aglycone
AD62334
Formula: C20H24O4

Smiles:
CC(=O)C1(O)C=CC2=C1C(=O)CC1C2CC=C2CC(O)CCC21C
HBA: 4 RingCount: 4
HBD: 2 FractionCSP3: 0.6
AlogP: 2.26 Num_rotatable_bonds: 1
MolWt: 328.41 Num_heavy_atoms: 24
TPSA: 74.6 NumAromaticRings: 0

Sugarmoiety
SD04457

COC1CC(O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3CC(OC)C(OC4CC(OC)C(OC5OC(CO)C(O)C(O)C5O)C(C)O4)C(C)O3)C(C)O2)C(C)O1