Vincamine

• CAS: 1617-90-9
• Catalog Number: ACM1617909
• Category: Other Products
• Molecular Weight: 354.4
• Molecular Formula: C₂₁H₂₆N₂O₃
• Synonyms: Pervincamine
• InChI: InChI=1S/C21H26N2O3/c1-3-20-10-6-11-22-12-9-15-14-7-4-5-8-16(14)23(17(15)18(20)22)21(25,13-20)19(24)26-2/h4-5,7-8,18,25H,3,6,9-13H2,1-2H3/t18-,20+,21+/m1/s1
• InChI Key: RXPRRQLKFXBCSJ-GIVPXCGWSA-N
• Melting Point: 232 °C
• Complexity: 598
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 3
• Exact Mass: 354.1943427
• Hazard Statements: Xn
• Heavy Atom Count: 26
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Isomeric SMILES: CC[C@@]12CCCN3[C@@H]1C4=C(CC3)C5=CC=CC=C5N4[C@](C2)(C(=O)OC)O
• Monoisotopic Mass: 354.1943427
• Physical State: Powder
• Rotatable Bond Count: 3
• Safety Description: 36
• Supplemental Hazard Statements: H302
• Symbol: GHS07
• Topological Polar Surface Area: 54.7 Ų

Custom Q&A

What is the molecular formula of Vincamine according to the reference?

The molecular formula of Vincamine is C21H26N2O3.

What is the molecular weight of Vincamine according to the reference?

The molecular weight of Vincamine is 354.4 g/mol.

What role does Vincamine play as mentioned in the reference?

Vincamine has a role as an antihypertensive agent, a vasodilator agent, and a metabolite.

Where is Vincamine obtained from, according to the reference?

Vincamine is obtained from the leaves of Vinca minor.

What is the IUPAC name of Vincamine according to the reference?

The IUPAC name of Vincamine is methyl (15S,17S,19S)-15-ethyl-17-hydroxy-1,11-diazapentacyclo[9.6.2.0 2,7 .0 8,18 .0 15,19]nonadeca-2,4,6,8(18)-tetraene-17-carboxylate.

What is the Canonical SMILES of Vincamine according to the reference?

The Canonical SMILES of Vincamine is CCC12CCCN3C1C4=C(CC3)C5=CC=CC=C5N4C(C2)(C(=O)OC)O.

What is the InChIKey of Vincamine according to the reference?

The InChIKey of Vincamine is RXPRRQLKFXBCSJ-GIVPXCGWSA-N.

What is the CAS number of Vincamine according to the reference?

The CAS number of Vincamine is 1617-90-9.

What is the XLogP3-AA value of Vincamine according to the reference?

The XLogP3-AA value of Vincamine is 2.9.

What is the Hydrogen Bond Donor Count of Vincamine according to the reference?

The Hydrogen Bond Donor Count of Vincamine is 1.