Nagilactone E

(1S,2R,5R,10S,13S,14R,17R)-13-hydroxy-10,14-dimethyl-5-propan-2-yl-3,6,16-trioxapentacyclo[8.6.1.02,4.04,9.014,17]heptadec-8-ene-7,15-dione

CAS: 36895-12-2

Molecular Formula	`C19H24O6`
Molecular Weight	348.4 g/mol
LogP	1.3
Topological Polar Surface Area	85.4 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	1
Exact Mass	348.1573
Heavy Atoms	25
Complexity	727.0

Chemical Identifiers

CAS Number	36895-12-2
SMILES	`CC(C)C1C23C(O2)C4C5C(C3=CC(=O)O1)(CCC(C5(C(=O)O4)C)O)C`
InChIKey	`JOTPYRMNAYGVBN-TYQYQVCMSA-N`

📖 Product Overview

Nagilactone E (CAS: 36895-12-2) is a chemical compound with molecular formula C19H24O6 and molecular weight 348.4 g/mol. Its IUPAC systematic name is (1S,2R,5R,10S,13S,14R,17R)-13-hydroxy-10,14-dimethyl-5-propan-2-yl-3,6,16-trioxapentacyclo[8.6.1.02,4.04,9.014,17]heptadec-8-ene-7,15-dione. LogP 1.3 Topological Polar Surface Area 85.4 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 6 Rotatable Bonds 1 Exact Mass 348.1573 Heavy Atoms 25 Complexity 727.0 InChI Key: JOTPYRMNAYGVBN-TYQYQVCMSA-N. SMILES: CC(C)C1C23C(O2)C4C5C(C3=CC(=O)O1)(CCC(C5(C(=O)O4)C)O)C.

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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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