CS-1172981
(1S,3R,Z)-5-(2-((1R,3aS,7aR,E)-1-((R)-6-Hydroxy-6-methylheptan-2-yl)-7a-methyloctahydro-4H-inden-4-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol Calcitriol impurity
Manufacturer: ChemScene
CAS Number: 96614-28-7
The price for this product is unavailable. Please request a quote
Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₇H₄₄O₃
Molecular Weight
416.64
Synonyms
None
SMILES
[H][C@]12/C(CCC[C@]1(C)[C@@H]([C@H](C)CCCC(C)(O)C)CC2)=C/C=C3C[C@H](O)C[C@@H](O)C/3=C
Tpsa
60.69
Logp
5.7047
H Acceptors
3
H Donors
3
Rotatable Bonds
6
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
Compare Similar Items
Show Difference
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₇H₄₄O₃
Molecular Weight: 416.64
Synonyms: None
SMILES: [H][C@]12/C(CCC[C@]1(C)[C@@H]([C@H](C)CCCC(C)(O)C)CC2)=C/C=C3C[C@H](O)C[C@@H](O)C/3=C
Tpsa: 60.69
Logp: 5.7047
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₇H₄₄O₃
Molecular Weight:
416.64
Synonyms:
None
SMILES:
[H][C@]12/C(CCC[C@]1(C)[C@@H]([C@H](C)CCCC(C)(O)C)CC2)=C/C=C3C[C@H](O)C[C@@H](O)C/3=C
Tpsa:
60.69
Logp:
5.7047
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₈H₄₄O
Molecular Weight: 396.65
Synonyms: None
SMILES: C[C@]12C(/C(CCC2)=C/C=C(C[C@@H](O)CC3)\C3=C)CC[C@@H]1[C@@H](CCC(C(C)C)=C)C
Tpsa: 20.23
Logp: 7.7851
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₄₄O
Molecular Weight:
396.65
Synonyms:
None
SMILES:
C[C@]12C(/C(CCC2)=C/C=C(C[C@@H](O)CC3)\C3=C)CC[C@@H]1[C@@H](CCC(C(C)C)=C)C
Tpsa:
20.23
Logp:
7.7851
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₃₄O₂
Molecular Weight: 282.46
Synonyms: None
SMILES: [H][C@]12[C@@H](CCC[C@]1([C@@H](CC2)[C@@H](C)CCCC(O)(C)C)C)O
Tpsa: 40.46
Logp: 4.141
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₃₄O₂
Molecular Weight:
282.46
Synonyms:
None
SMILES:
[H][C@]12[C@@H](CCC[C@]1([C@@H](CC2)[C@@H](C)CCCC(O)(C)C)C)O
Tpsa:
40.46
Logp:
4.141
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₀H₄₆O₃
Molecular Weight: 454.68
Synonyms: None
SMILES: C[C@@]12[C@](CC[C@@H]2[C@@H](/C=C/[C@@H](OC(C)C)C3CC3)C)([H])/C(CCC1)=C/C=C4C[C@@H](O)C[C@H](O)C/4=C
Tpsa: 49.69
Logp: 6.5233
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₀H₄₆O₃
Molecular Weight:
454.68
Synonyms:
None
SMILES:
C[C@@]12[C@](CC[C@@H]2[C@@H](/C=C/[C@@H](OC(C)C)C3CC3)C)([H])/C(CCC1)=C/C=C4C[C@@H](O)C[C@H](O)C/4=C
Tpsa:
49.69
Logp:
6.5233
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
7