4-Morpholineacetic acid, alpha-methyl-, 3-ethenyldodecahydro-1-oxo-3,4a,7,7,10a-pentamethyl-6,10,10b-trihydroxy-1H-naphtho(2,1-b)pyran-5-yl ester, hydrochloride, hydrate (4:5:4)

Base Information

• Chemical Name: 4-Morpholineacetic acid, alpha-methyl-, 3-ethenyldodecahydro-1-oxo-3,4a,7,7,10a-pentamethyl-6,10,10b-trihydroxy-1H-naphtho(2,1-b)pyran-5-yl ester, hydrochloride, hydrate (4:5:4)
• CAS No.: 115076-72-7
• Molecular Formula: C27H43 N O8 . 5/4 Cl H
• Molecular Weight: 2220.83358
• Mol file: 115076-72-7.mol

Synonyms:115076-72-7;4-Morpholineacetic acid, alpha-methyl-, 3-ethenyldodecahydro-1-oxo-3,4a,7,7,10a-pentamethyl-6,10,10b-trihydroxy-1H-naphtho(2,1-b)pyran-5-yl ester, hydrochloride, hydrate (4:5:4);C27H43NO8.5/4ClH.H2O;C27-H43-N-O8.5/4Cl-H.H2-O

Chemical Property of 4-Morpholineacetic acid, alpha-methyl-, 3-ethenyldodecahydro-1-oxo-3,4a,7,7,10a-pentamethyl-6,10,10b-trihydroxy-1H-naphtho(2,1-b)pyran-5-yl ester, hydrochloride, hydrate (4:5:4)

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: g/cm³
• Hydrogen Bond Donor Count: 17
• Hydrogen Bond Acceptor Count: 36
• Rotatable Bond Count: 20
• Exact Mass: 2220.079263
• Heavy Atom Count: 149
• Complexity: 917

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C(=O)OC1C(C2C(CCC(C2(C3(C1(OC(CC3=O)(C)C=C)C)O)C)O)(C)C)O)N4CCOCC4.CC(C(=O)OC1C(C2C(CCC(C2(C3(C1(OC(CC3=O)(C)C=C)C)O)C)O)(C)C)O)N4CCOCC4.CC(C(=O)OC1C(C2C(CCC(C2(C3(C1(OC(CC3=O)(C)C=C)C)O)C)O)(C)C)O)N4CCOCC4.CC(C(=O)OC1C(C2C(CCC(C2(C3(C1(OC(CC3=O)(C)C=C)C)O)C)O)(C)C)O)N4CCOCC4.Cl.Cl.Cl.Cl.Cl