AG24924
487-41-2 | Forsythin
Manufacturer: A2B Chem
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CatalogNumber
AG24924
ChemicalName
Forsythin
CasNumber
487-41-2
MolecularFormula
C27H34O11
MolecularWeight
534.5523
MdlNumber
MFCD29505477
Smiles
OC[C@H]1O[C@@H](Oc2ccc(c(c2)OC)[C@H]2OC[C@H]3[C@@H]2CO[C@H]3c2ccc(c(c2)OC)OC)[C@@H]([C@H]([C@@H]1O)O)O
Complexity
757
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
9
HeavyAtomCount
38
HydrogenBondAcceptorCount
11
HydrogenBondDonorCount
4
RotatableBondCount
8
Xlogp3
0.8
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CatalogNumber: AG24924
ChemicalName: Forsythin
CasNumber: 487-41-2
MolecularFormula: C27H34O11
MolecularWeight: 534.5523
MdlNumber: MFCD29505477
Smiles: OC[C@H]1O[C@@H](Oc2ccc(c(c2)OC)[C@H]2OC[C@H]3[C@@H]2CO[C@H]3c2ccc(c(c2)OC)OC)[C@@H]([C@H]([C@@H]1O)O)O
Complexity: 757
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 9
HeavyAtomCount: 38
HydrogenBondAcceptorCount: 11
HydrogenBondDonorCount: 4
RotatableBondCount: 8
Xlogp3: 0.8
CatalogNumber:
AG24924
ChemicalName:
Forsythin
CasNumber:
487-41-2
MolecularFormula:
C27H34O11
MolecularWeight:
534.5523
MdlNumber:
MFCD29505477
Smiles:
OC[C@H]1O[C@@H](Oc2ccc(c(c2)OC)[C@H]2OC[C@H]3[C@@H]2CO[C@H]3c2ccc(c(c2)OC)OC)[C@@H]([C@H]([C@@H]1O)O)O
Complexity:
757
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
9
HeavyAtomCount:
38
HydrogenBondAcceptorCount:
11
HydrogenBondDonorCount:
4
RotatableBondCount:
8
Xlogp3:
0.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCN1C(=O)C2=C(C1=O)CCCC2
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCN1C(=O)C2=C(C1=O)CCCC2
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AG24926
ChemicalName: 3,6-Dichlorophthalic anhydride
CasNumber: 4466-59-5
MolecularFormula: C8H2Cl2O3
MolecularWeight: 217.00568
MdlNumber: MFCD00042786
Smiles: O=C1OC(=O)c2c1c(Cl)ccc2Cl
Complexity: 240
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.5
CatalogNumber:
AG24926
ChemicalName:
3,6-Dichlorophthalic anhydride
CasNumber:
4466-59-5
MolecularFormula:
C8H2Cl2O3
MolecularWeight:
217.00568
MdlNumber:
MFCD00042786
Smiles:
O=C1OC(=O)c2c1c(Cl)ccc2Cl
Complexity:
240
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__