 Home > Encyclopedia > (4,5,16,17-tetrahydroxy-6,14,18-trimethyl-9-oxo-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-en-8-yl) 2-acetyloxy-2-methylbutanoate

(4,5,16,17-tetrahydroxy-6,14,18-trimethyl-9-oxo-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-en-8-yl) 2-acetyloxy-2-methylbutanoate

(4,5,16,17-tetrahydroxy-6,14,18-trimethyl-9-oxo-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-en-8-yl) 2-acetyloxy-2-methylbutanoate structure

CAS No:
68703-93-5
Formula:
C27H38O11
Chemical Name:
(4,5,16,17-tetrahydroxy-6,14,18-trimethyl-9-oxo-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-en-8-yl) 2-acetyloxy-2-methylbutanoate
Synonyms:
NSC297898;68703-93-5;Glaucarubine-2'-acetate;GLAUCARUBINE, 2'-ACETYL;DTXSID80315861;NSC-297898

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(4,5,16,17-tetrahydroxy-6,14,18-trimethyl-9-oxo-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-en-8-yl) 2-acetyloxy-2-methylbutanoate Basic Attributes

Molecular Weight：

538.6 g/mol

Exact Mass：

538.24141202 g/mol

NSC Number：

297898

DSSTox ID：

DTXSID80315861

Characteristics

PSA：

169 Å²

Computed Properties

Molecular Weight:538.6
XLogP3:0.4
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:6
Exact Mass:538.24141202
Monoisotopic Mass:538.24141202
Topological Polar Surface Area:169
Heavy Atom Count:38
Complexity:1090
Undefined Atom Stereocenter Count:13
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (4,5,16,17-tetrahydroxy-6,14,18-trimethyl-9-oxo-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-en-8-yl) 2-acetyloxy-2-methylbutanoate

Basic Attributes
Characteristics
Computed Properties
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