(+)-Heliotrine
CAS Registry Number®
303-33-3
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CAS Name
(+)-HeliotrineMolecular Formula
C16H27NO5Molecular Mass
313.39Cite this Page
(+)-Heliotrine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=303-33-3 (retrieved ) (CAS RN: 303-33-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
125-126 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C16H27NO5/c1-10(2)16(20,11(3)21-4)15(19)22-9-12-5-7-17-8-6-13(18)14(12)17/h5,10-11,13-14,18,20H,6-9H2,1-4H3/t11-,13+,14-,16+/m1/s1
InChIKey
InChIKey=LMFKRLGHEKVMNT-UJDVCPFMSA-N
SMILES
C(OC([C@@]([C@H](OC)C)([C@@H](C)C)O)=O)C=1[C@]2(N(CC1)CC[C@@H]2O)[H]
Canonical SMILES
O=C(OCC1=CCN2CCC(O)C12)C(O)(C(OC)C)C(C)C
Other Names for this Substance
- Butanoic acid, 2-hydroxy-2-[(1R)-1-methoxyethyl]-3-methyl-, [(1S,7aR)-2,3,5,7a-tetrahydro-1-hydroxy-1H-pyrrolizin-7-yl]methyl ester, (2S)-
- Heliotrine
- Butanoic acid, 2-hydroxy-2-(1-methoxyethyl)-3-methyl-, (2,3,5,7a-tetrahydro-1-hydroxy-1H-pyrrolizin-7-yl)methyl ester, [1S-[1α,7[R*(S*)],7aα]]-
- (+)-Heliotrine
- 7S-Heliotrine
