Compound C30H38N2O15

[5-(1,3-benzodioxol-5-yloxy)-4-(1,3-benzodioxol-5-yloxymethyl)-4-(methylcarbamoyloxy)pentyl]-dimethylazanium;2-(carboxymethyl)-2,4-dihydroxy-4-oxobutanoate

CAS: 64246-07-7

Molecular Formula	`C30H38N2O15`
Molecular Weight	666.6 g/mol
Topological Polar Surface Area	233.0 A2
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	15
Rotatable Bonds	16
Exact Mass	666.22723
Heavy Atoms	47
Complexity	836.0

Chemical Identifiers

CAS Number	64246-07-7
SMILES	`CNC(=O)OC(CCC[NH+](C)C)(COC1=CC2=C(C=C1)OCO2)COC3=CC4=C(C=C3)OCO4.C(C(=O)O)C(CC(=O)O)(C(=O)[O-])O`
InChIKey	`DEUJMXDTFVLZKP-UHFFFAOYSA-N`

📖 Product Overview

Compound C30H38N2O15 (CAS: 64246-07-7) is a chemical compound with molecular formula C30H38N2O15 and molecular weight 666.6 g/mol. Its IUPAC systematic name is [5-(1,3-benzodioxol-5-yloxy)-4-(1,3-benzodioxol-5-yloxymethyl)-4-(methylcarbamoyloxy)pentyl]-dimethylazanium;2-(carboxymethyl)-2,4-dihydroxy-4-oxobutanoate. Topological Polar Surface Area 233.0 A2 Hydrogen Bond Donors 5 Hydrogen Bond Acceptors 15 Rotatable Bonds 16 Exact Mass 666.22723 Heavy Atoms 47 Complexity 836.0 InChI Key: DEUJMXDTFVLZKP-UHFFFAOYSA-N. SMILES: CNC(=O)OC(CCC[NH+](C)C)(COC1=CC2=C(C=C1)OCO2)COC3=CC4=C(C=C3)OCO4.C(C(=O)O)C(CC(=O)O)(C(=O)[O-])O.

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