AE34665
13382-86-0 | Manninotriose
Manufacturer: A2B Chem
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CatalogNumber
AE34665
ChemicalName
Manninotriose
CasNumber
13382-86-0
MolecularFormula
C18H32O16
MolecularWeight
504.4371
MdlNumber
MFCD30478852
Smiles
O=C[C@@H]([C@H]([C@@H]([C@@H](CO[C@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@@H]([C@@H]([C@H]2O)O)O)[C@@H]([C@@H]([C@H]1O)O)O)O)O)O)O
Complexity
625
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
14
HeavyAtomCount
34
HydrogenBondAcceptorCount
16
HydrogenBondDonorCount
11
RotatableBondCount
11
Xlogp3
-7.2
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CatalogNumber: AE34665
ChemicalName: Manninotriose
CasNumber: 13382-86-0
MolecularFormula: C18H32O16
MolecularWeight: 504.4371
MdlNumber: MFCD30478852
Smiles: O=C[C@@H]([C@H]([C@@H]([C@@H](CO[C@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@@H]([C@@H]([C@H]2O)O)O)[C@@H]([C@@H]([C@H]1O)O)O)O)O)O)O
Complexity: 625
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 14
HeavyAtomCount: 34
HydrogenBondAcceptorCount: 16
HydrogenBondDonorCount: 11
RotatableBondCount: 11
Xlogp3: -7.2
CatalogNumber:
AE34665
ChemicalName:
Manninotriose
CasNumber:
13382-86-0
MolecularFormula:
C18H32O16
MolecularWeight:
504.4371
MdlNumber:
MFCD30478852
Smiles:
O=C[C@@H]([C@H]([C@@H]([C@@H](CO[C@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@@H]([C@@H]([C@H]2O)O)O)[C@@H]([C@@H]([C@H]1O)O)O)O)O)O)O
Complexity:
625
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
14
HeavyAtomCount:
34
HydrogenBondAcceptorCount:
16
HydrogenBondDonorCount:
11
RotatableBondCount:
11
Xlogp3:
-7.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: CCCCCCCCCC(=O)Oc1c[nH]c2c1cc(Br)cc2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Smiles:
CCCCCCCCCC(=O)Oc1c[nH]c2c1cc(Br)cc2
Complexity:
__
Covalently-bondedUnitCount:
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DefinedAtomStereocenterCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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MolecularFormula: __
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Smiles: CC(=O)NC1C(OCc2ccccc2)OC2C(C1O)OC(OC2)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
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HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
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Smiles:
CC(=O)NC1C(OCc2ccccc2)OC2C(C1O)OC(OC2)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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MdlNumber: __
Smiles: Cc1cc(Cl)n2c(n1)cc(n2)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1cc(Cl)n2c(n1)cc(n2)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__