CS-0914191
(4aS,4bS,5aS,6aS,7R,8R,9aS,9bS)-4'-chloro-5'-(furan-2-yl)-4a,6a,8-trimethyl-5a,6,6a,8,9,9a,9b,10-octahydro-3'H,11H-spiro[cyclopenta[1,2]phenanthro[4,4a-b]oxirene-7,2'-furan]-2,3'(4aH)-dione
Manufacturer: ChemScene
CAS Number: 722495-06-9
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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
C₂₇H₂₇ClO₅
Molecular Weight
466.95
Synonyms
None
SMILES
C[C@@]12[C@@]34[C@@](O3)(C[C@@]5(C)[C@]([C@@]4(CCC1=CC(=O)C=C2)[H])(C[C@@H](C)[C@@]56OC(=C(Cl)C6=O)C7=CC=CO7)[H])[H]
Tpsa
69.04
Logp
5.2103
H Acceptors
5
H Donors
0
Rotatable Bonds
1
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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: C₂₇H₂₇ClO₅
Molecular Weight: 466.95
Synonyms: None
SMILES: C[C@@]12[C@@]34[C@@](O3)(C[C@@]5(C)[C@]([C@@]4(CCC1=CC(=O)C=C2)[H])(C[C@@H](C)[C@@]56OC(=C(Cl)C6=O)C7=CC=CO7)[H])[H]
Tpsa: 69.04
Logp: 5.2103
H Acceptors: 5
H Donors: 0
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:
C₂₇H₂₇ClO₅
Molecular Weight:
466.95
Synonyms:
None
SMILES:
C[C@@]12[C@@]34[C@@](O3)(C[C@@]5(C)[C@]([C@@]4(CCC1=CC(=O)C=C2)[H])(C[C@@H](C)[C@@]56OC(=C(Cl)C6=O)C7=CC=CO7)[H])[H]
Tpsa:
69.04
Logp:
5.2103
H Acceptors:
5
H Donors:
0
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: C₂₉H₃₄O₇S
Molecular Weight: 526.64
Synonyms: None
SMILES: C[C@@]12[C@@]34[C@@](O3)(C[C@@]5(C)[C@]([C@@]4(CCC1=CC(=O)C=C2)[H])(C[C@@H](C)[C@@]5(C(COS(=O)(=O)C6=CC=C(C)C=C6)=O)O)[H])[H]
Tpsa: 110.27
Logp: 3.68572
H Acceptors: 7
H Donors: 1
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:
C₂₉H₃₄O₇S
Molecular Weight:
526.64
Synonyms:
None
SMILES:
C[C@@]12[C@@]34[C@@](O3)(C[C@@]5(C)[C@]([C@@]4(CCC1=CC(=O)C=C2)[H])(C[C@@H](C)[C@@]5(C(COS(=O)(=O)C6=CC=C(C)C=C6)=O)O)[H])[H]
Tpsa:
110.27
Logp:
3.68572
H Acceptors:
7
H Donors:
1
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: C₁₄H₁₇ClN₂O₂S
Molecular Weight: 312.81
Synonyms: None
SMILES: [Cl-].O=S(=O)(C1=CC=C(C=C1)C)[N+]2=CC=C(C=C2)N(C)C
Tpsa: 41.26
Logp: -1.41048
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₇ClN₂O₂S
Molecular Weight:
312.81
Synonyms:
None
SMILES:
[Cl-].O=S(=O)(C1=CC=C(C=C1)C)[N+]2=CC=C(C=C2)N(C)C
Tpsa:
41.26
Logp:
-1.41048
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₄H₃₆O₉S
Molecular Weight: 620.71
Synonyms: None
SMILES: C[C@@]12[C@@]34[C@]([C@]5([C@](C)(C[C@@]3(O4)[H])[C@@](OC(=O)C6=CC=CO6)(C(COS(=O)(=O)C7=CC=C(C)C=C7)=O)[C@H](C)C5)[H])(CCC1=CC(=O)C=C2)[H]
Tpsa: 129.48
Logp: 5.14342
H Acceptors: 9
H Donors: 0
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:
C₃₄H₃₆O₉S
Molecular Weight:
620.71
Synonyms:
None
SMILES:
C[C@@]12[C@@]34[C@]([C@]5([C@](C)(C[C@@]3(O4)[H])[C@@](OC(=O)C6=CC=CO6)(C(COS(=O)(=O)C7=CC=C(C)C=C7)=O)[C@H](C)C5)[H])(CCC1=CC(=O)C=C2)[H]
Tpsa:
129.48
Logp:
5.14342
H Acceptors:
9
H Donors:
0
Rotatable Bonds:
7