CAS | 98243-57-3 |
Structure | |
Synonyms | (3beta,5alpha,6beta,17beta)-Cevane-3,6-diol |
IUPAC Name | (1R,2S,6S,9S,10R,11R,14S,15S,17R,18S,20S,23R,24S)-6,10,23-trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosane-17,20-diol |
Molecular Weight | 415.65 |
Molecular Formula | C27H45NO2 |
Canonical SMILES | C[C@H]1CC[C@H]2[C@@H]([C@@H]3CC[C@@H]4[C@H]([C@@H]3CN2C1)C[C@H]5[C@H]4C[C@H]([C@@H]6[C@@]5(CC[C@@H](C6)O)C)O)C |
InChI | InChI=1S/C27H45NO2/c1-15-4-7-25-16(2)18-5-6-19-20(22(18)14-28(25)13-15)11-23-21(19)12-26(30)24-10-17(29)8-9-27(23,24)3/h15-26,29-30H,4-14H2,1-3H3/t15-,16+,17-,18-,19+,20+,21-,22+,23-,24+,25-,26+,27+/m0/s1 |
InChI Key | NEMWYOKGHGSVSC-MSSYMPDSSA-N |
Boiling Point | 538.0±35.0 °C |
Melting Point | 181-182 °C |
Purity | 98% |
Density | 1.13±0.1 g/ml |
Appearance | Powder |
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