Spirosolan-3-ol, hydrochloride (1:1), (3β,5α,22β,25S)-
CAS Registry Number®
6192-62-7
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CAS Name
Spirosolan-3-ol, hydrochloride (1:1), (3β,5α,22β,25S)-Molecular Formula
C27H45NO2.ClHCite this Page
Spirosolan-3-ol, hydrochloride (1:1), (3β,5α,22β,25S)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=6192-62-7 (retrieved ) (CAS RN: 6192-62-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
275-280 °C (decomp)
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C27H45NO2.ClH/c1-16-7-12-27(28-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(29)8-10-25(18,3)21(20)9-11-26(22,24)4;/h16-24,28-29H,5-15H2,1-4H3;1H/t16-,17-,18-,19-,20+,21-,22-,23-,24-,25-,26-,27-;/m0./s1
InChIKey
InChIKey=SXXHVPYRDFJKPG-VXJLCZPPSA-N
SMILES
C[C@@H]1[C@@]2(O[C@@]3([C@]1([C@]4(C)[C@@](C3)([C@]5([C@](CC4)([C@]6(C)[C@@](CC5)(C[C@@H](O)CC6)[H])[H])[H])[H])[H])[H])CC[C@H](C)CN2.Cl
Canonical SMILES
Cl.OC1CCC2(C)C(CCC3C2CCC4(C)C3CC5OC6(NCC(C)CC6)C(C)C54)C1
Other Names for this Substance
- Spirosolan-3-ol, hydrochloride (1:1), (3β,5α,22β,25S)-
- 5α-Tomatidin-3β-ol, hydrochloride
- Spirosolan-3-ol, hydrochloride, (3β,5α,22β,25S)-
- Tomatidin hydrochloride
- Tomatidine hydrochloride
Deleted or Replaced CAS Registry Numbers
894413-04-8
