Glycoside

GD141337
Name:
Mutactimycin PrFormula:
C32H38O15Smiles:
COC1C(O)C(C)OC(OC2CC(C)(O)Cc3c(O)c4c(c(O)c32)C(=O)c2c(OC3OC(C)C(O)C(O)C3O)cccc2C4=O)C1OAglycone:
CC1(O)Cc2c(O)c3c(c(O)c2C(O)C1)C(=O)c1c(O)cccc1C3=OSugarmoiety:
CC1OC(O)C(O)C(O)C1O.COC1C(O)C(C)OC(O)C1OOther Identifiers
Properties
HBA: | 15 | RingCount: | 6 |
HBD: | 8 | FractionCSP3: | 0.56 |
AlogP: | -0.68 | Num_rotatable_bonds: | 5 |
MolWt: | 662.64 | Num_heavy_atoms: | 47 |
TPSA: | 242.13 | NumAromaticRings: | 2 |
Unique Aglycone
AD19138
Formula: C19H16O7
Smiles:
CC1(O)Cc2c(O)c3c(c(O)c2C(O)C1)C(=O)c1c(O)cccc1C3=OHBA: | 7 | RingCount: | 4 |
HBD: | 5 | FractionCSP3: | 0.26 |
AlogP: | 1.31 | Num_rotatable_bonds: | 0 |
MolWt: | 356.33 | Num_heavy_atoms: | 26 |
TPSA: | 135.29 | NumAromaticRings: | 2 |