Rauvotetraphylline C

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For Research Use Only.

Category

Alkaloids

Cat.No.

NP0225

CAS

1422506-51-1

Product Name

Rauvotetraphylline C

Structure

Product Details

Description

Rauvotetraphylline C is an alkaloid isolated from the aerial parts of Rauvolfia tetraphylla.

Synonyms

Rauvotetraphylline C; 1422506-51-1; 4-[(1S,12S,14S,15E,16R)-15-ethylidene-16-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraen-13-yl]but-3-en-2-one

IUPAC Name

4-[(1S,12S,14S,15E,16R)-15-ethylidene-16-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraen-13-yl]but-3-en-2-one

Molecular Weight

510.587

Molecular Formula

C28H34N2O7

Canonical SMILES

CC=C1C2CC3C4=C(CC(C2C=CC(=O)C)N3C1OC5C(C(C(C(O5)CO)O)O)O)C6=CC=CC=C6N4

InChI

InChI=1S/C28H34N2O7/c1-3-14-17-10-21-23-18(15-6-4-5-7-19(15)29-23)11-20(16(17)9-8-13(2)32)30(21)27(14)37-28-26(35)25(34)24(33)22(12-31)36-28/h3-9,16-17,20-22,24-29,31,33-35H,10-12H2,1-2H3/b9-8+,14-3+/t16-,17+,20+,21+,22-,24-,25+,26-,27-,28+/m1/s1

InChIKey

WJIXKXVKQDQVFT-QGMXRPOQSA-N

Purity

96.5%

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