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(2S,3S,4S)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methyl]pentane-1,2,5-triol

(2S,3S,4S)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methyl]pentane-1,2,5-triol structure

CAS No:
76236-36-7
Formula:
C23H30O8
Chemical Name:
(2S,3S,4S)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methyl]pentane-1,2,5-triol
Synonyms:
PODOPHYLLOTOXIN,SECODEOXY-SECOLACTONE DIOL;

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(2S,3S,4S)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methyl]pentane-1,2,5-triol Basic Attributes

Molecular Weight：

434.48000

Exact Mass：

434.19406791

NSC Number：

332049

DSSTox ID：

DTXSID50422657

Characteristics

PSA：

106.84000

XLogP3：

1.80420

Density：

1.269g/cm3

Boiling Point：

667.4ºC at 760 mmHg

Flash Point：

357.4ºC

Refractive Index：

1.581

Computed Properties

Molecular Weight:434.5
XLogP3:2.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:11
Exact Mass:434.19406791
Monoisotopic Mass:434.19406791
Topological Polar Surface Area:107
Heavy Atom Count:31
Complexity:506
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (2S,3S,4S)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methyl]pentane-1,2,5-triol

Basic Attributes
Characteristics
Computed Properties

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