Acetylheliotrine

[(7S)-7-acetyloxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl 2-hydroxy-2-(1-methoxyethyl)-3-methylbutanoate

CAS: 26607-98-7

Molecular Formula	`C18H29NO6`
Molecular Weight	355.4 g/mol
LogP	0.7
Topological Polar Surface Area	85.3 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	9
Exact Mass	355.1995
Heavy Atoms	25
Complexity	546.0

Chemical Identifiers

CAS Number	26607-98-7
SMILES	`CC(C)C(C(C)OC)(C(=O)OCC1=CCN2C1C(CC2)OC(=O)C)O`
InChIKey	`TYFHUMUZGWLROC-OTPKUTMYSA-N`

📖 Product Overview

Acetylheliotrine (CAS: 26607-98-7) is a chemical compound with molecular formula C18H29NO6 and molecular weight 355.4 g/mol. Its IUPAC systematic name is [(7S)-7-acetyloxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl 2-hydroxy-2-(1-methoxyethyl)-3-methylbutanoate. LogP 0.7 Topological Polar Surface Area 85.3 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 7 Rotatable Bonds 9 Exact Mass 355.1995 Heavy Atoms 25 Complexity 546.0 InChI Key: TYFHUMUZGWLROC-OTPKUTMYSA-N. SMILES: CC(C)C(C(C)OC)(C(=O)OCC1=CCN2C1C(CC2)OC(=O)C)O.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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