$20.00
| CAS No.: | 77-60-1 |
| Molecular Formula | C₂₇H₄₄O₃ |
| Molecular Weight | 416.6g/mol |
| Purity | HPLC>98% |
| Chemical Family | Steroids |
| Weight |
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IUPAC Name: (1R,2S,4S,5’R,6R,7S,8R,9S,12S,13S,16S,18S)-5′,7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2′-oxane]-16-ol
InChI: InChI=1S/C27H44O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h16-24,28H,5-15H2,1-4H3/t16-,17+,18+,19+,20-,21+,22+,23+,24+,25+,26+,27-/m1/s1
InChIKey: GMBQZIIUCVWOCD-MFRNJXNGSA-N
Canonical SMILES: CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)O)C)C)C)OC1
Isomeric SMILES: C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@@H]6[C@@]5(CC[C@@H](C6)O)C)C)C)OC1
Synonyms: Tigogenin; 77-60-1; (25R)-5alpha-Spirostan-3beta-ol; 5-alpha-Spirostan-3-beta-ol; (5alpha,25R)-Spirostan-3beta-ol; 4SMU15RR44; CHEBI:9595; (2aS,2’R,4S,5’R,6aS,6bS,8aS,8bR,9S,11aS,12aS,12bR)-5′,6a,8a,9-Tetramethyldocosahydrospiro[naphtho[2′,1′:4,5]indeno[2,1-b]furan-10,2′-pyran]-4-ol; …
Botanical Source: Agave sisalana Perr. ex Engelm.
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