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20-Ethyl-7,8-dihydroxy-1,6,16-trimethoxy-4-(methoxymethyl)aconitan-14-yl 2-methylbutanoate

HCID 157147
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Basic information

CAS
78039-66-4
Standard SMILES
CCC(C)C(=O)OC1C2CC3C1C(O)(CC2OC)C1(O)C(OC)C2C4(COC)CCC(OC)C32C1N(CC)C4
InChIKey
CKXXSHYXJATMHS-UHFFFAOYSA-N
Molecular formula
C30H49NO8
Average molar mass
551.721 g/mol
Monoisotopic mass
551.34581753

Names & identifiers

Preferred name
20-Ethyl-7,8-dihydroxy-1,6,16-trimethoxy-4-(methoxymethyl)aconitan-14-yl 2-methylbutanoate
IUPAC
20-Ethyl-7,8-dihydroxy-1,6,16-trimethoxy-4-(methoxymethyl)aconitan-14-yl 2-methylbutanoate

Database identifiers

CAS
78039-66-4
PubChem CID
157147
DTXSID
DTXSID30999291

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