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Catalog | BBC81678468 |
CAS | 81678-46-8 |
Structure | ![]() |
Synonyms | 3-Dehydro-15-deoxoeucosterol |
IUPAC Name | (3'R,4S,5R,5'S,10S,13S,14S,17S)-4-(hydroxymethyl)-3',4,10,13,14-pentamethyl-5'-propanoylspiro[2,5,6,7,11,12,15,16-octahydro-1H-cyclopenta[a]phenanthrene-17,2'-oxolane]-3-one |
Molecular Weight | 456.66 |
Molecular Formula | C29H44O4 |
Canonical SMILES | CCC(=O)[C@@H]1C[C@H]([C@@]2(O1)CC[C@@]3([C@@]2(CCC4=C3CC[C@@H]5[C@@]4(CCC(=O)[C@]5(C)CO)C)C)C)C |
InChI | InChI=1S/C29H44O4/c1-7-21(31)22-16-18(2)29(33-22)15-14-27(5)20-8-9-23-25(3,19(20)10-13-28(27,29)6)12-11-24(32)26(23,4)17-30/h18,22-23,30H,7-17H2,1-6H3/t18-,22+,23-,25-,26-,27+,28+,29+/m1/s1 |
InChI Key | KHSHJGYTLGFEMC-LBQQCSDXSA-N |
Purity | 98% |
Appearance | Solid |
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