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Aconitine

Name: Aconitine
Brand: 2A Biotech
SKU: 2A-9009050

CAS Number302-27-2

SynonymsNCI60_004380; 16-Ethyl-1alpha,6alpha,19beta-trimethoxy-4-(methoxymethyl)-aconitane-3alpha,8,10alpha,11,18alpha-pentol, 8-acetate 10-benzoate; 20-ethyl-3alpha,13,15alpha-trihydroxy-1alpha,6alpha,16beta-trimethoxy-4-(methoxymethyl)aconitane-8,14alpha-diyl 8-acetate 14-benzoate; CHEBI:2430; STOCK1N-54397

Molecular FormulaC34H47NO11

Molecular Weight645.7454

Purity98.00%

MSDSChinese English

Cat. No.: 2A-9009050 Purity: 98.00%

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Quality Control of [ 302-27-2 ] Purity: 98.00% SDS Specification MoL

Chemical & Physical Properties
CAS Number	302-27-2
Catalog No.	2A-9009050
Synonyms	NCI60_004380; 16-Ethyl-1alpha,6alpha,19beta-trimethoxy-4-(methoxymethyl)-aconitane-3alpha,8,10alpha,11,18alpha-pentol, 8-acetate 10-benzoate; 20-ethyl-3alpha,13,15alpha-trihydroxy-1alpha,6alpha,16beta-trimethoxy-4-(methoxymethyl)aconitane-8,14alpha-diyl 8-acetate 14-benzoate; CHEBI:2430; STOCK1N-54397
Molecular Formula	C34H47NO11
Molecular Weight	645.7454
Purity	98.00
SMILES	CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@]6(O)[C@@H](OC)[C@H](O)[C@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)C14)[C@H]5[C@H]6OC(=O)c7ccccc7
InChI	InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1
InChI Key	InChIKey=XFSBVAOIAHNAPC-XTHSEXKGSA-N

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Aconitine

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