AB71797
3650-09-7 | Carnosic acid
Manufacturer: A2B Chem
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CatalogNumber
AB71797
ChemicalName
Carnosic acid
CasNumber
3650-09-7
MolecularFormula
C20H28O4
MolecularWeight
332.4339
MdlNumber
MFCD02259459
Smiles
OC(=O)C12CCCC(C2CCc2c1c(O)c(c(c2)C(C)C)O)(C)C
NscNumber
694080
Complexity
500
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
24
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
2
Xlogp3
4.9
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CatalogNumber: AB71797
ChemicalName: Carnosic acid
CasNumber: 3650-09-7
MolecularFormula: C20H28O4
MolecularWeight: 332.4339
MdlNumber: MFCD02259459
Smiles: OC(=O)C12CCCC(C2CCc2c1c(O)c(c(c2)C(C)C)O)(C)C
NscNumber: 694080
Complexity: 500
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 2
Xlogp3: 4.9
CatalogNumber:
AB71797
ChemicalName:
Carnosic acid
CasNumber:
3650-09-7
MolecularFormula:
C20H28O4
MolecularWeight:
332.4339
MdlNumber:
MFCD02259459
Smiles:
OC(=O)C12CCCC(C2CCc2c1c(O)c(c(c2)C(C)C)O)(C)C
NscNumber:
694080
Complexity:
500
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
2
Xlogp3:
4.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1O[C@@H]2C[C@@H]3[C@@]1(CCCC3(C)C)c1c2cc(c(c1O)O)C(C)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
O=C1O[C@@H]2C[C@@H]3[C@@]1(CCCC3(C)C)c1c2cc(c(c1O)O)C(C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1OC(=O)C2C1C2(C)C
NscNumber: __
Complexity: 207
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1OC(=O)C2C1C2(C)C
NscNumber:
__
Complexity:
207
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: __
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
__
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__