AI50868
477-43-0 | Dehydrocostus lactone
Manufacturer: A2B Chem
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CatalogNumber
AI50868
ChemicalName
Dehydrocostus lactone
CasNumber
477-43-0
MolecularFormula
C15H18O2
MolecularWeight
230.3022
MdlNumber
MFCD00210277
Smiles
C=C1C(=O)OC2C1CCC(=C)C1C2C(=C)CC1
Complexity
432
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
4
HeavyAtomCount
17
HydrogenBondAcceptorCount
2
Xlogp3
2.6
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CatalogNumber: AI50868
ChemicalName: Dehydrocostus lactone
CasNumber: 477-43-0
MolecularFormula: C15H18O2
MolecularWeight: 230.3022
MdlNumber: MFCD00210277
Smiles: C=C1C(=O)OC2C1CCC(=C)C1C2C(=C)CC1
Complexity: 432
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 4
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
Xlogp3: 2.6
CatalogNumber:
AI50868
ChemicalName:
Dehydrocostus lactone
CasNumber:
477-43-0
MolecularFormula:
C15H18O2
MolecularWeight:
230.3022
MdlNumber:
MFCD00210277
Smiles:
C=C1C(=O)OC2C1CCC(=C)C1C2C(=C)CC1
Complexity:
432
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
4
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
Xlogp3:
2.6
CatalogNumber: AI50869
ChemicalName: Bergenin
CasNumber: 477-90-7
MolecularFormula: C14H16O9
MolecularWeight: 328.2714
MdlNumber: MFCD00167248
Smiles: OC[C@H]1O[C@@H]2[C@@H]([C@H]([C@@H]1O)O)OC(=O)c1c2c(O)c(c(c1)O)OC
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
Xlogp3: __
CatalogNumber:
AI50869
ChemicalName:
Bergenin
CasNumber:
477-90-7
MolecularFormula:
C14H16O9
MolecularWeight:
328.2714
MdlNumber:
MFCD00167248
Smiles:
OC[C@H]1O[C@@H]2[C@@H]([C@H]([C@@H]1O)O)OC(=O)c1c2c(O)c(c(c1)O)OC
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccccc1Sc1ccc(cc1)C=O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccccc1Sc1ccc(cc1)C=O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
Xlogp3:
__
CatalogNumber: AI50871
ChemicalName: tert-Butyl N-{2-[(5-cyanopyridin-2-yl)amino]ethyl}carbamate
CasNumber: 477290-49-6
MolecularFormula: C13H18N4O2
MolecularWeight: 262.3076
MdlNumber: MFCD24391875
Smiles: N#Cc1ccc(nc1)NCCNC(=O)OC(C)(C)C
Complexity: 342
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
Xlogp3: 1.6
CatalogNumber:
AI50871
ChemicalName:
tert-Butyl N-{2-[(5-cyanopyridin-2-yl)amino]ethyl}carbamate
CasNumber:
477290-49-6
MolecularFormula:
C13H18N4O2
MolecularWeight:
262.3076
MdlNumber:
MFCD24391875
Smiles:
N#Cc1ccc(nc1)NCCNC(=O)OC(C)(C)C
Complexity:
342
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
Xlogp3:
1.6