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(1R,2S,3R,4R,6S,7S,8S,14R)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxotricyclo[5.4.3.0¹,?]tetradecan-6-yl 2-(methanesulfonyloxy)acetate

(1R,2S,3R,4R,6S,7S,8S,14R)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxotricyclo[5.4.3.0¹,?]tetradecan-6-yl 2-(methanesulfonyloxy)acetate

CAS: 60924-38-1

Formula: C23H36O7S

SMILES: [H][C@]12C(=O)CC[C@@]11CC[C@@H](C)[C@]2(C)[C@H](C[C@](C)(C=C)[C@H](O)[C@H]1C)OC(=O)COS(C)(=O)=O

IUPAC: (1R,2S,3R,4R,6S,7S,8S,14R)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxotricyclo[5.4.3.0¹,?]tetradecan-6-yl 2-(methanesulfonyloxy)acetate

InChI: InChI=1S/C23H36O7S/c1-7-21(4)12-17(30-18(25)13-29-31(6,27)28)22(5)14(2)8-10-23(15(3)20(21)26)11-9-16(24)19(22)23/h7,14-15,17,19-20,26H,1,8-13H2,2-6H3/t14-,15-,17+,19-,20-,21+,22-,23-/m1/s1

Composition: C (60.50%), H (7.95%), O (24.53%), S (7.02%)

Molar Mass: 456.59

Atom Count: 67

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 8
Exact Mass 456.218174673
Formal Charge 0
FSP3 0.83
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey IKVZCNHNKCXZHZ-VIRBKFQOSA-N
Lipinski's Rule of Five 1
Molar Refractivity 115
Topological Polar Surface Area 106.97
Polarizability 47.06
Ring Count 3
Rotatable Bond Count 6

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Purity (%)
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Days
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CLEARSYNTH LABS
Purity LeadTime CAS PacketSize UnitPrice
97% <14 Days 60924-38-1 $33.66-$3,084.48$33.66$193.80$440.64$751.74$1,762.56$3,084.48
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