ChemicalBook--->CAS DataBase List--->2182-14-1

2182-14-1

2182-14-1 Structure

2182-14-1 Structure
IdentificationBack Directory
[Name]

Vindoline
[CAS]

2182-14-1
[Synonyms]

vindolin
VINDOLINE
NSC 91994
Vindoline Tartrate
Vindoline, froM Myrica rubra
thoxy-1-methyl-,methylester,(2-beta,3-beta,4-beta,5-alpha,12-beta,19-alpha)
aspidospermidine-3-carboxylicacid,4-(acetyloxy)-6,7-didehydro-3-hydroxy-16-me
(2beta,3beta,4beta,5alpha,12beta,19alpha)-4-(Acetyloxy)-6,7-didehydro-3-hydroxy-16-Methoxy-1-Methyl-aspidosperMidine
Methyl (2β,3β,4β,5α,12R,19α)-4-(Acetyloxy)-6,7-didehydro-3-hydroxy-16-methoxy-1-methylaspidospermidine-3-carboxylate
(2β,5α,12β,19α)-1-Methyl-3-hydroxy-4β-acetoxy-16-methoxy-6,7-didehydroaspidospermidine-3α-carboxylic acid methyl ester
(2β,5α,12β,19α)-4β-Acetyloxy-6,7-didehydro-3β-hydroxy-16-methoxy-1-methylaspidospermidine-3-carboxylic acid methyl ester
(2β,5α,12R,19α)-4β-(Acetyloxy)-6,7-didehydro-3β-hydroxy-16-methoxy-1-methylaspidospermidine-3-carboxylic acid methyl ester
(2,3,4,5a,12,19a)-4-(Acetyloxy)-6,7-didehydro-3-hydroxy-16-methoxy-1-methyl-aspidospermidine-3-carboxylic Acid Methyl Ester
(2β,3β,4β,5α,12β,19α)-4-(Acetyloxy)-6,7-didehydro-3-hydroxy-16-Methoxy-1-Methyl-aspidosperMidine-3-carboxylic Acid Methyl Ester
Aspidospermidine-3-carboxylic acid, 4-(acetyloxy)-6,7-didehydro-3-hydroxy-16-methoxy-1-methyl-, methyl ester, (2b,3b,4b,5a,12R,19a)-
Aspidospermidine-3-carboxylic acid, 4-(acetyloxy)-6,7-didehydro-3-hydroxy-16-methoxy-1- methyl-, methyl ester, (2b,3b,4b,5a,12b,19a)-
AspidosperMidine-3-carboxylicacid, 4-(acetyloxy)-6,7-didehydro-3-hydroxy-16-Methoxy-1-Methyl-, Methyl ester,(2b,3b,4b,5a,12R,19a)- (9CI)
(2beta,3beta,4beta,5alpha,12beta,19alpha)-4-(acetyloxy)-6,7-didehydro-3-hydroxy-16-methoxy-1-methyl-aspidospermidine-3-carboxylic acid methyl ester
Aspidospermidine-3-carboxylic acid, 4-(acetyloxy)-6,7-didehydro-3-hydroxy-16-methoxy-1-methyl-, methyl ester, (2beta,3beta,4beta,5alpha,12beta,19alpha)-
[EINECS(EC#)]

218-558-0
[Molecular Formula]

C25H32N2O6
[MDL Number]

MFCD01744432
[MOL File]

2182-14-1.mol
[Molecular Weight]

456.53
Chemical PropertiesBack Directory
[Appearance]

Off-White Solid
[Melting point ]

163-1650C
[alpha ]

D20 -18° (chloroform); D27 +42° (chloroform)
[Boiling point ]

569.8±50.0 °C(Predicted)
[density ]

1.33±0.1 g/cm3(Predicted)
[storage temp. ]

-20°C Freezer
[solubility ]

Chloroform (Slightly), Ethanol (Slightly), Methanol (Slightly)
[form ]

White to off-white crystalline powder.
[pka]

5.5 in 66% DMF (Moza, Trojánek)
[color ]

White to Off-White
[InChIKey]

CXBGOBGJHGGWIE-KCXUSKTKNA-N
[SMILES]

[C@@]123CCN4CC=C[C@](CC)([C@H](OC(=O)C)[C@@](O)(C(=O)OC)[C@@]1([H])N(C1C=C(OC)C=CC2=1)C)[C@]34[H] |&1:0,7,10,15,21,33,r|
Hazard InformationBack Directory
[Chemical Properties]

Off-White Solid
[Uses]

A novel antitumor agent
[Definition]

ChEBI: Vindoline is a vinca alkaloid, an alkaloid ester, an organic heteropentacyclic compound, a methyl ester, an acetate ester, a tertiary amino compound and a tertiary alcohol. It is a conjugate base of a vindolinium(1+).
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

68
[Safety Statements ]

36/37-24/25
[RTECS ]

CJ0120000
[HS Code ]

29339900
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Vindoline(2182-14-1).msds
Spectrum DetailBack Directory
[Spectrum Detail]

Vindoline(2182-14-1)1HNMR
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