NSC72122

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Creator
US National Cancer Institute
Publication Date
2005-08-24
Alternative Title
Raunescin
Raunescine
RAUNESCINE
Yohimban-16-carboxylic acid, 17-hydroxy-18-[(3,4,5-trimethoxybenzoyl)oxy]-, methyl ester, (3.beta.,16.beta.,17.alpha.,18.beta.,20.alpha.)- (9CI)
3.beta., 20.alpha.-Yohimban-16.beta.-carboxylic acid, 17.alpha., 18.beta.-dihydroxy-, methyl ester, 18-(3,4,5-trimethoxybenzoate) (8CI)
3,4,5-Trimethoxybenzoyl methyl raunescate
Publisher
Unilever Center for Molecular Informatics, Cambridge University
Language
en_GB
Type
Chemical Structures
Metadata
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Citation
Unknown author (2005). NSC72122. [chemical structure]. http://www.dspace.cam.ac.uk/handle/1810/64521
Identifiers
NSC72122
This record's URL: http://www.dspace.cam.ac.uk/handle/1810/64521
IUPAC Chemical Identifier (IChI): C31H36N2O8,1H3-37-19-9H-16(10H-20(38-2H3)22(19)39-3H3)24(34)41-29H-13H2-26H-15H2-33-12H2-11H2-21-17-7H-5H-6H-8H-18(17)32H-23(21)27H(33)14H2-28H(26)30H(31H(29)36H)25(35)40-4H3
IUPAC/NIST Chemical Identifier (INChI): InChI=1S/C31H36N2O8/c1-37-24-11-16(12-25(38-2)29(24)39-3)30(35)41-23-13-17-15-33-10-9-19-18-7-5-6-8-21(18)32-27(19)22(33)14-20(17)26(28(23)34)31(36)40-4/h5-8,11-12,17,20,22-23,26,28,32,34H,9-10,13-15H2,1-4H3/t17-,20+,22-,23-,26+,28+/m1/s1
IUPAC/NIST Chemical Identifier Key (INChI): UGMYHMZSPHJQHL-UTYXIPFNSA-N