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CYMBIDINE-A
SpectraBase Compound ID 64cZbGdvZqp
InChI InChI=1S/C39H63N7O20/c1-14(2)25(34(55)45-21(37(60)61)10-11-24(50)44-20(9-7-8-19(40)36(58)59)33(54)41-15(3)35(56)57)46-32(53)16(4)63-31-27(43-18(6)49)38-62-13-23(65-38)30(31)66-39-26(42-17(5)48)29(52)28(51)22(12-47)64-39/h14-16,19-23,25-31,38-39,47,51-52H,7-13,40H2,1-6H3,(H,41,54)(H,42,48)(H,43,49)(H,44,50)(H,45,55)(H,46,53)(H,56,57)(H,58,59)(H,60,61)/t15-,16-,19-,20+,21-,22+,23+,25-,26+,27-,28+,29+,30-,31-,38-,39-/m1/s1
InChIKey XDNIIFNXNXDUJI-GGYSCDGJSA-N
Mol Weight 950.0 g/mol
Molecular Formula C39H63N7O20
Exact Mass 949.412787 g/mol
Enantiomer InChIKey XDNIIFNXNXDUJI-FMKKMGKJSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent H2O:D2O=9:1
Title Journal or Book Year
Structure of Cymbidine A, a Monomeric Peptidoglycan-Related Compound with Hypotensive and Diuretic Activities, Isolated from a Higher Plant, Cymbidium goeringii (Orchidaceae) Chemical and Pharmaceutical Bulletin 2007

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