CS-0637798
Gambogic acid B
Manufacturer: ChemScene
CAS Number: 887923-50-4
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₄₀H₅₀O₉
Molecular Weight
674.82
Synonyms
None
SMILES
OC(/C(C)=C\C[C@@]12[C@@]34[C@](C(C5=C(O)C(C=C[C@](C)(O6)CC/C=C(C)/C)=C6C(C/C=C(C)\C)=C5O4)=O)([H])[C@H]([C@@](C[C@@]3([H])C(C)(O2)C)([H])C1=O)OCC)=O
Tpsa
128.59
Logp
7.3342
H Acceptors
8
H Donors
2
Rotatable Bonds
10
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄₀H₅₀O₉
Molecular Weight: 674.82
Synonyms: None
SMILES: OC(/C(C)=C\C[C@@]12[C@@]34[C@](C(C5=C(O)C(C=C[C@](C)(O6)CC/C=C(C)/C)=C6C(C/C=C(C)\C)=C5O4)=O)([H])[C@H]([C@@](C[C@@]3([H])C(C)(O2)C)([H])C1=O)OCC)=O
Tpsa: 128.59
Logp: 7.3342
H Acceptors: 8
H Donors: 2
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₀H₅₀O₉
Molecular Weight:
674.82
Synonyms:
None
SMILES:
OC(/C(C)=C\C[C@@]12[C@@]34[C@](C(C5=C(O)C(C=C[C@](C)(O6)CC/C=C(C)/C)=C6C(C/C=C(C)\C)=C5O4)=O)([H])[C@H]([C@@](C[C@@]3([H])C(C)(O2)C)([H])C1=O)OCC)=O
Tpsa:
128.59
Logp:
7.3342
H Acceptors:
8
H Donors:
2
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₉BrClNO₂
Molecular Weight: 278.53
Synonyms: 6-Bromo-1,2,3,5-tetrahydro-4,1-benzoxazepine (hydrochloride)
SMILES: BrC1=C2C(NC(COC2)=O)=CC=C1.Cl
Tpsa: 38.33
Logp: 2.3396
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₉BrClNO₂
Molecular Weight:
278.53
Synonyms:
6-Bromo-1,2,3,5-tetrahydro-4,1-benzoxazepine (hydrochloride)
SMILES:
BrC1=C2C(NC(COC2)=O)=CC=C1.Cl
Tpsa:
38.33
Logp:
2.3396
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₁F₂N
Molecular Weight: 147.17
Synonyms: None
SMILES: FC1(F)CC(C2NCC2)C1
Tpsa: 12.03
Logp: 1.3936
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₁F₂N
Molecular Weight:
147.17
Synonyms:
None
SMILES:
FC1(F)CC(C2NCC2)C1
Tpsa:
12.03
Logp:
1.3936
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₆FIN₂O
Molecular Weight: 268.03
Synonyms: None
SMILES: NC1=NC(F)=CC(I)=C1OC
Tpsa: 48.14
Logp: 1.4161
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₆FIN₂O
Molecular Weight:
268.03
Synonyms:
None
SMILES:
NC1=NC(F)=CC(I)=C1OC
Tpsa:
48.14
Logp:
1.4161
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1