1-Acetyltagitinin A

Modify Date: 2025-09-19 19:40:01

1-Acetyltagitinin A Structure
1-Acetyltagitinin A structure
Common Name 1-Acetyltagitinin A
CAS Number 60547-63-9 Molecular Weight 410.458
Density 1.2±0.1 g/cm3 Boiling Point 532.1±50.0 °C at 760 mmHg
Molecular Formula C21H30O8 Melting Point N/A
MSDS N/A Flash Point 179.4±23.6 °C

 Names

Name 1-Acetyltagitinin A
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.2±0.1 g/cm3
Boiling Point 532.1±50.0 °C at 760 mmHg
Molecular Formula C21H30O8
Molecular Weight 410.458
Flash Point 179.4±23.6 °C
Exact Mass 410.194061
PSA 108.36000
LogP 1.70
Vapour Pressure 0.0±3.2 mmHg at 25°C
Index of Refraction 1.528
InChIKey MFYNTWZAYXDJQB-VQHMBOPWSA-N
SMILES C=C1C(=O)OC2CC(C)C3(O)CC(OC(C)=O)C(C)(CC(OC(=O)C(C)C)C12)O3

 Safety Information

Hazard Codes Xi

 Synonyms

(1S,2S,4R,8S,9R,12R)-12-Acetoxy-1-hydroxy-2,11-dimethyl-7-methylene-6-oxo-5,14-dioxatricyclo[9.2.1.0]tetradec-9-yl 2-methylpropanoate
Propanoic acid, 2-methyl-, (3aS,4R,6S,7R,9S,10S,11aR)-7-(acetyloxy)dodecahydro-9-hydroxy-6,10-dimethyl-3-methylene-2-oxo-6,9-epoxycyclodeca[b]furan-4-yl ester
Propanoic acid, 2-methyl-, (3aS,4R,7R,9S,10S,11aR)-7-(acetyloxy)dodecahydro-9-hydroxy-6,10-dimethyl-3-methylene-2-oxo-6,9-epoxycyclodeca[b]furan-4-yl ester
(1S,2S,4R,8S,9R,11S,12R)-12-Acetoxy-1-hydroxy-2,11-dimethyl-7-methylene-6-oxo-5,14-dioxatricyclo[9.2.1.0]tetradec-9-yl 2-methylpropanoate
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