Structure

Vindoline

CAS
2182-14-1
Catalog Number
ACM2182141
Category
Inhibitors
Molecular Weight
456.5
Molecular Formula
C25H32N2O6

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Specification

Description
Vindoline, a vinca alkaloid extracted from the leaves of Catharanthus roseus, weakly inhibits tubulin self-assembly.
Synonyms
(2β,5α,12R,19α)-4β-(Acetyloxy)-6,7-didehydro-3β-hydroxy-16-methoxy-1-methylaspidospermidine-3-carboxylic acid methyl ester
Canonical SMILES
CC[C@@]1(C=CCN2CC3)[C@@]2([H])[C@@]3(C4=CC=C(OC)C=C4N5C)[C@]5([H])[C@](C(OC)=O)(O)[C@@H]1OC(C)=O
InChI
InChI=1S/C25H32N2O6/c1-6-23-10-7-12-27-13-11-24(19(23)27)17-9-8-16(31-4)14-18(17)26(3)20(24)25(30,22(29)32-5)21(23)33-15(2)28/h7-10,14,19-21,30H,6,11-13H2,1-5H3/t19-,20+,21+,23+,24+,25-/m0/s1
InChI Key
CXBGOBGJHGGWIE-ACSXSLCXSA-N
Melting Point
163-165 °C
Appearance
Solid
Storage
4°C, protect from light*In solvent : -80°C, 6 months; -20°C, 1 month (protect from light).
Complexity
864
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
6
Exact Mass
456.22603674
Heavy Atom Count
33
Hydrogen Bond Acceptor Count
8
Hydrogen Bond Donor Count
1
Isomeric SMILES
CC[C@@]12C=CCN3[C@@H]1[C@]4(CC3)[C@H]([C@]([C@@H]2OC(=O)C)(C(=O)OC)O)N(C5=C4C=CC(=C5)OC)C
Monoisotopic Mass
456.22603674
Physical State
Powder
Rotatable Bond Count
6
Shipping
Can be shipped at room temperature, where not in use may vary.
Source
PlantsApocynaceaeCatharanthus roseus (L.) G. Don
Topological Polar Surface Area
88.5 Ų
What is the chemical formula of Vindoline?

The chemical formula of Vindoline is C25H32N2O6.

What is the melting point of Vindoline?

The melting point of Vindoline is 163-165°C.

What is the boiling point of Vindoline?

The boiling point of Vindoline is 569.8±50.0 °C (Predicted).

In what solvents is Vindoline slightly soluble?

Vindoline is slightly soluble in chloroform, ethanol, and methanol.

What are the safety hazard codes for Vindoline?

The safety hazard code for Vindoline is Xn.

What is the main usage of Vindoline?

Vindoline is used as a novel antitumor agent.

What is the color of Vindoline?

Vindoline is white to off-white in color.

What is the storage temperature recommended for Vindoline?

Vindoline should be stored at -20°C in a freezer.

What is the HS Code for Vindoline?

The HS Code for Vindoline is 29339900.

What is the molecular weight of Vindoline?

The molecular weight of Vindoline is 456.53.

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