GYPSOPHIN-A;CYCLO-[PROLINE(1)-TYROSINE(2)-SERINE(3)-PHENYLALANINE(4)-PHENYLALANINE(5)-VALINE(6)-ISOLEUCINE(7)-GLUTAMINE(8)]

SpectraBase Compound ID	6Nsw4vCeuwN
InChI	InChI=1S/C51H67N9O11/c1-5-30(4)43-50(70)53-35(22-23-41(52)63)51(71)60-24-12-17-40(60)48(68)56-37(27-33-18-20-34(62)21-19-33)45(65)57-39(28-61)47(67)55-36(25-31-13-8-6-9-14-31)44(64)54-38(26-32-15-10-7-11-16-32)46(66)58-42(29(2)3)49(69)59-43/h6-11,13-16,18-21,29-30,35-40,42-43,61-62H,5,12,17,22-28H2,1-4H3,(H2,52,63)(H,53,70)(H,54,64)(H,55,67)(H,56,68)(H,57,65)(H,58,66)(H,59,69)/t30?,35-,36-,37-,38-,39-,40-,42-,43-/m0/s1
InChIKey	OVDYWAHDMCYSJU-NRYVVTGFSA-N Google Search
Mol Weight	982.1 g/mol
Molecular Formula	C51H67N9O11
Exact Mass	981.496004 g/mol

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SpectraBase Spectrum ID	H48Om5lUY2T
Name	GYPSOPHIN-A;CYCLO-[PROLINE(1)-TYROSINE(2)-SERINE(3)-PHENYLALANINE(4)-PHENYLALANINE(5)-VALINE(6)-ISOLEUCINE(7)-GLUTAMINE(8)]
Compound Number	1
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C51H67N9O11
InChI	InChI=1S/C51H67N9O11/c1-5-30(4)43-50(70)53-35(22-23-41(52)63)51(71)60-24-12-17-40(60)48(68)56-37(27-33-18-20-34(62)21-19-33)45(65)57-39(28-61)47(67)55-36(25-31-13-8-6-9-14-31)44(64)54-38(26-32-15-10-7-11-16-32)46(66)58-42(29(2)3)49(69)59-43/h6-11,13-16,18-21,29-30,35-40,42-43,61-62H,5,12,17,22-28H2,1-4H3,(H2,52,63)(H,53,70)(H,54,64)(H,55,67)(H,56,68)(H,57,65)(H,58,66)(H,59,69)/t30?,35-,36-,37-,38-,39-,40-,42-,43-/m0/s1
InChIKey	OVDYWAHDMCYSJU-NRYVVTGFSA-N
Literature Reference Author	G.WANG,J.G.LUO,M.H.YANG,X.B.WANG,L.Y.KONG
Literature Reference Citation	CHEM.PHARM.BULL.,61,489(2013)
Literature Reference DOI	10.1248/cpb.c12-01094
Molecular Weight	982.147 g/mol
Source File Reference	UWBT4924