[L-HOMOARGININE(2)]-NODULARIN;CYCLO-(D-ERYTHRO-BETA-METHYLASPARTIC-ACID-L-HOMOARGININE-(2S,3S,8S,9S)-3-AMINO-9-METHOXY-2,6,8-TRIMETHYL-10-PHENYLDECA-4(E),6(E)-

SpectraBase Compound ID	CixojIPtlKQ
InChI	InChI=1S/C42H62N8O10/c1-8-32-39(55)49-35(41(58)59)27(5)37(53)47-30(16-12-13-21-45-42(43)44)38(54)46-29(26(4)36(52)48-31(40(56)57)19-20-34(51)50(32)6)18-17-24(2)22-25(3)33(60-7)23-28-14-10-9-11-15-28/h8-11,14-15,17-18,22,25-27,29-31,33,35H,12-13,16,19-21,23H2,1-7H3,(H,46,54)(H,47,53)(H,48,52)(H,49,55)(H,56,57)(H,58,59)(H4,43,44,45)/b18-17+,24-22+,32-8-/t25-,26-,27+,29+,30-,31-,33-,35-/m1/s1
InChIKey	YCFHEUGHSRSOFR-JMEJHLNPSA-N Google Search
Mol Weight	839.0 g/mol
Molecular Formula	C42H62N8O10
Exact Mass	838.45889 g/mol

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SpectraBase Spectrum ID	9gfbFwxuEhW
Name	[L-HOMOARGININE(2)]-NODULARIN;CYCLO-(D-ERYTHRO-BETA-METHYLASPARTIC-ACID-L-HOMOARGININE-(2S,3S,8S,9S)-3-AMINO-9-METHOXY-2,6,8-TRIMETHYL-10-PHENYLDECA-4(E),6(E)-
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C42H62N8O10
InChI	InChI=1S/C42H62N8O10/c1-8-32-39(55)49-35(41(58)59)27(5)37(53)47-30(16-12-13-21-45-42(43)44)38(54)46-29(26(4)36(52)48-31(40(56)57)19-20-34(51)50(32)6)18-17-24(2)22-25(3)33(60-7)23-28-14-10-9-11-15-28/h8-11,14-15,17-18,22,25-27,29-31,33,35H,12-13,16,19-21,23H2,1-7H3,(H,46,54)(H,47,53)(H,48,52)(H,49,55)(H,56,57)(H,58,59)(H4,43,44,45)/b18-17+,24-22+,32-8-/t25-,26-,27+,29+,30-,31-,33-,35-/m1/s1
InChIKey	YCFHEUGHSRSOFR-JMEJHLNPSA-N
Literature Reference Author	K.A.BEATTIE,K.KAYA,G.A.CODD
Literature Reference Citation	PHYTOCHEM.,54,57(2000)
Literature Reference DOI	10.1016/S0031-9422(00)00045-5
Molecular Weight	839.002 g/mol
Solvent	CD3OD
Source File Reference	UWLU1215