CAS#: 87147-48-6 Product: (1S,3R,5Z,7E)-1,3,23,25-Tetrahydroxy-9,10-secocholesta-5,7,10-trien-24-one No suppilers available for the product. |
Name | (1S,3R,5Z,7E)-1,3,23,25-Tetrahydroxy-9,10-secocholesta-5,7,10-trien-24-one |
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Synonyms | (1S)-1,23,25-trihydroxy-24-oxocalciol; (1S,3R,5Z |
Molecular Structure | ![]() |
Molecular Formula | C27H42O5 |
Molecular Weight | 446.62 |
CAS Registry Number | 87147-48-6 |
SMILES | O=C(C(O)(C)C)C(O)C[C@@H](C)[C@H]3CC[C@H]2C(=C\C=C1/C(=C)[C@@H](O)C[C@H](O)C1)\CCC[C@@]23C |
InChI | 1S/C27H42O5/c1-16(13-24(30)25(31)26(3,4)32)21-10-11-22-18(7-6-12-27(21,22)5)8-9-19-14-20(28)15-23(29)17(19)2/h8-9,16,20-24,28-30,32H,2,6-7,10-15H2,1,3-5H3/b18-8+,19-9-/t16-,20-,21-,22+,23+,24?,27-/m1/s1 |
InChIKey | ARRIBDAUGOLZSJ-QEEPAQDXSA-N |
Density | 1.155g/cm3 (Cal.) |
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Boiling point | 621.305°C at 760 mmHg (Cal.) |
Flash point | 343.567°C (Cal.) |
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