AA58514
13850-91-4 | Boc-DL-N-Me-Val-OH
Manufacturer: A2B Chem
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CatalogNumber
AA58514
ChemicalName
Boc-DL-N-Me-Val-OH
CasNumber
13850-91-4
MolecularFormula
C11H21NO4
MolecularWeight
231.2887
MdlNumber
MFCD00153317
Smiles
CC([C@H](N(C(=O)OC(C)(C)C)C)C(=O)O)C
Complexity
268
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
5
UndefinedAtomStereocenterCount
1
Xlogp3
2.1
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CatalogNumber: AA58514
ChemicalName: Boc-DL-N-Me-Val-OH
CasNumber: 13850-91-4
MolecularFormula: C11H21NO4
MolecularWeight: 231.2887
MdlNumber: MFCD00153317
Smiles: CC([C@H](N(C(=O)OC(C)(C)C)C)C(=O)O)C
Complexity: 268
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 5
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.1
CatalogNumber:
AA58514
ChemicalName:
Boc-DL-N-Me-Val-OH
CasNumber:
13850-91-4
MolecularFormula:
C11H21NO4
MolecularWeight:
231.2887
MdlNumber:
MFCD00153317
Smiles:
CC([C@H](N(C(=O)OC(C)(C)C)C)C(=O)O)C
Complexity:
268
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C1CCCN(C1)C(=O)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C1CCCN(C1)C(=O)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AA58517
ChemicalName: Tormentic acid
CasNumber: 13850-16-3
MolecularFormula: C30H48O5
MolecularWeight: 488.6991
MdlNumber: MFCD09970923
Smiles: O[C@@H]1C[C@@]2(C)[C@H](C([C@H]1O)(C)C)CC[C@@]1([C@@H]2CC=C2[C@@]1(C)CC[C@@]1([C@H]2[C@](C)(O)[C@H](C)CC1)C(=O)O)C
Complexity: 956
Covalently-bondedUnitCount: 1
HeavyAtomCount: 35
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 4
RotatableBondCount: 1
UndefinedAtomStereocenterCount: __
Xlogp3: 5
CatalogNumber:
AA58517
ChemicalName:
Tormentic acid
CasNumber:
13850-16-3
MolecularFormula:
C30H48O5
MolecularWeight:
488.6991
MdlNumber:
MFCD09970923
Smiles:
O[C@@H]1C[C@@]2(C)[C@H](C([C@H]1O)(C)C)CC[C@@]1([C@@H]2CC=C2[C@@]1(C)CC[C@@]1([C@H]2[C@](C)(O)[C@H](C)CC1)C(=O)O)C
Complexity:
956
Covalently-bondedUnitCount:
1
HeavyAtomCount:
35
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
4
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
__
Xlogp3:
5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__