 Home > Encyclopedia > (2aR,8aβ,8bα)-Decahydro-3α,5α-diacetoxy-7α-[(3R,5S)-5-acetoxy-3-(3-furyl)-2-methyl-1-cyclopenten-1-yl]-8α-benzoyloxy-2a,5aβ,7-trimethyl-2H-naphtho[1,8-bc]furan-6β-acetic acid methyl ester

(2aR,8aβ,8bα)-Decahydro-3α,5α-diacetoxy-7α-[(3R,5S)-5-acetoxy-3-(3-furyl)-2-methyl-1-cyclopenten-1-yl]-8α-benzoyloxy-2a,5aβ,7-trimethyl-2H-naphtho[1,8-bc]furan-6β-acetic acid methyl ester

(2aR,8aβ,8bα)-Decahydro-3α,5α-diacetoxy-7α-[(3R,5S)-5-acetoxy-3-(3-furyl)-2-methyl-1-cyclopenten-1-yl]-8α-benzoyloxy-2a,5aβ,7-trimethyl-2H-naphtho[1,8-bc]furan-6β-acetic acid methyl ester structure

CAS No:
76689-95-7
Formula:
C40H48O12
Chemical Name:
(2aR,8aβ,8bα)-Decahydro-3α,5α-diacetoxy-7α-[(3R,5S)-5-acetoxy-3-(3-furyl)-2-methyl-1-cyclopenten-1-yl]-8α-benzoyloxy-2a,5aβ,7-trimethyl-2H-naphtho[1,8-bc]furan-6β-acetic acid methyl ester
Synonyms:
Nimbolidin A;76689-95-7;DTXSID30997999;2H-Naphtho(1,8-bc)furan-6-acetic acid, 3,5-bis(acetyloxy)-7-((3R,5S)-5-(acetyloxy)-3-(3-furanyl)-2-methyl-1-cyclopenten-1-yl)-8-(benzoyloxy)decahydro-2a,5a,7-trimethyl-, methyl ester, (2aR,3R,5S,5aR,6R,7R,8S,8aR,8bR)-;3,5-Bis(acetyloxy)-7-[5-(acetyloxy)-3-(furan-3-yl)-2-methylcyclopent-1-en-1-yl]-6-(2-methoxy-2-oxoethyl)-2a,5a,7-trimethyldecahydro-2H-naphtho[1,8-bc]furan-8-yl benzoate

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(2aR,8aβ,8bα)-Decahydro-3α,5α-diacetoxy-7α-[(3R,5S)-5-acetoxy-3-(3-furyl)-2-methyl-1-cyclopenten-1-yl]-8α-benzoyloxy-2a,5aβ,7-trimethyl-2H-naphtho[1,8-bc]furan-6β-acetic acid methyl ester Basic Attributes

Molecular Weight：

720.8 g/mol

Exact Mass：

720.31457696 g/mol

Characteristics

PSA：

154 Å²

Computed Properties

Molecular Weight:720.8
XLogP3:4.5
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:14
Exact Mass:720.31457696
Monoisotopic Mass:720.31457696
Topological Polar Surface Area:154
Heavy Atom Count:52
Complexity:1470
Defined Atom Stereocenter Count:10
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (2aR,8aβ,8bα)-Decahydro-3α,5α-diacetoxy-7α-[(3R,5S)-5-acetoxy-3-(3-furyl)-2-methyl-1-cyclopenten-1-yl]-8α-benzoyloxy-2a,5aβ,7-trimethyl-2H-naphtho[1,8-bc]furan-6β-acetic acid methyl ester

Basic Attributes
Characteristics
Computed Properties
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