CS-0101438
(1R,3S,E)-5-(2-((1R,3aS,7aR,E)-1-((2R,5S)-5,6-Dimethylheptan-2-yl)-7a-methyloctahydro-4H-inden-4-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol
Manufacturer: ChemScene
CAS Number: 83465-05-8
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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
C₂₈H₄₆O₂
Molecular Weight
414.66
Synonyms
9,10-Secoergosta-5,7,10(19)-triene-1,3-diol, (1α,3β,5E,7E)- (9CI)
SMILES
C[C@H](C(C)C)CC[C@@H](C)[C@H]([C@]1(CCC/2)C)CC[C@@]1([H])C2=C\C=C3C[C@@H](O)C[C@H](O)C/3=C
Tpsa
40.46
Logp
6.8358
H Acceptors
2
H Donors
2
Rotatable Bonds
6
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | (1R,3S,E)-5-((E)-2-((1R,3aS,7aR)-1-((2R,5S)-5,6-Dimethylheptan-2-yl)-7a-methylhexahydro-1H-inden-4(2H)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol | ChemScene | -- |
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
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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: C₂₈H₄₆O₂
Molecular Weight: 414.66
Synonyms: 9,10-Secoergosta-5,7,10(19)-triene-1,3-diol, (1α,3β,5E,7E)- (9CI)
SMILES: C[C@H](C(C)C)CC[C@@H](C)[C@H]([C@]1(CCC/2)C)CC[C@@]1([H])C2=C\C=C3C[C@@H](O)C[C@H](O)C/3=C
Tpsa: 40.46
Logp: 6.8358
H Acceptors: 2
H Donors: 2
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:
C₂₈H₄₆O₂
Molecular Weight:
414.66
Synonyms:
9,10-Secoergosta-5,7,10(19)-triene-1,3-diol, (1α,3β,5E,7E)- (9CI)
SMILES:
C[C@H](C(C)C)CC[C@@H](C)[C@H]([C@]1(CCC/2)C)CC[C@@]1([H])C2=C\C=C3C[C@@H](O)C[C@H](O)C/3=C
Tpsa:
40.46
Logp:
6.8358
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₇H₄₄O₂
Molecular Weight: 400.64
Synonyms: None
SMILES: CC(C)CCC[C@@H](C)[C@H]([C@]1(CCC/2)C)CC[C@@]1([H])C2=C\C=C3C[C@@H](O)C[C@@H](O)C/3=C
Tpsa: 40.46
Logp: 6.5898
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₇H₄₄O₂
Molecular Weight:
400.64
Synonyms:
None
SMILES:
CC(C)CCC[C@@H](C)[C@H]([C@]1(CCC/2)C)CC[C@@]1([H])C2=C\C=C3C[C@@H](O)C[C@@H](O)C/3=C
Tpsa:
40.46
Logp:
6.5898
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₉H₇₂O₂Si₂
Molecular Weight: 629.16
Synonyms: CalcitriolImpurity34
SMILES: C[C@]1([C@@H]([C@H](C)CCCC(C)C)CC[C@@]/21[H])CCCC2=C/C=C3C([C@H](O[Si](C)(C(C)(C)C)C)C[C@H](O[Si](C)(C(C)(C)C)C)C/3)=C
Tpsa: 18.46
Logp: 12.6488
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₉H₇₂O₂Si₂
Molecular Weight:
629.16
Synonyms:
CalcitriolImpurity34
SMILES:
C[C@]1([C@@H]([C@H](C)CCCC(C)C)CC[C@@]/21[H])CCCC2=C/C=C3C([C@H](O[Si](C)(C(C)(C)C)C)C[C@H](O[Si](C)(C(C)(C)C)C)C/3)=C
Tpsa:
18.46
Logp:
12.6488
H Acceptors:
2
H Donors:
0
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: C₂₀H₁₇NO₅
Molecular Weight: 351.35
Synonyms: None
SMILES: O=C1N2CCC3=C(C=C4OCOC4=C3)C2=CC5=C(OC)C(OC)=CC=C15
Tpsa: 58.92
Logp: 2.9705
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₁₇NO₅
Molecular Weight:
351.35
Synonyms:
None
SMILES:
O=C1N2CCC3=C(C=C4OCOC4=C3)C2=CC5=C(OC)C(OC)=CC=C15
Tpsa:
58.92
Logp:
2.9705
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
2