For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
CYCLO[-(D-VAL-L-LAC-L-VAL-D-PRO)4-]
SpectraBase Compound ID CuF9sQeVlfb
InChI InChI=1S/C72H116N12O20/c1-33(2)49-65(93)81-29-21-25-45(81)61(89)77-54(38(11)12)70(98)102-42(18)58(86)74-51(35(5)6)67(95)83-31-23-27-47(83)63(91)79-56(40(15)16)72(100)104-44(20)60(88)76-52(36(7)8)68(96)84-32-24-28-48(84)64(92)80-55(39(13)14)71(99)103-43(19)59(87)75-50(34(3)4)66(94)82-30-22-26-46(82)62(90)78-53(37(9)10)69(97)101-41(17)57(85)73-49/h33-56H,21-32H2,1-20H3,(H,73,85)(H,74,86)(H,75,87)(H,76,88)(H,77,89)(H,78,90)(H,79,91)(H,80,92)/t41-,42-,43-,44-,45+,46+,47+,48+,49-,50-,51-,52-,53+,54+,55+,56+/m1/s1
InChIKey HLCKHUOOUINDAS-AAXSBOKLSA-N
Mol Weight 1469.8 g/mol
Molecular Formula C72H116N12O20
Exact Mass 1468.842884 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1gKpHiTRu8G
Name CYCLO[-(D-VAL-L-LAC-L-VAL-D-PRO)4-]
Comments 8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C72H116N12O20
InChI InChI=1S/C72H116N12O20/c1-33(2)49-65(93)81-29-21-25-45(81)61(89)77-54(38(11)12)70(98)102-42(18)58(86)74-51(35(5)6)67(95)83-31-23-27-47(83)63(91)79-56(40(15)16)72(100)104-44(20)60(88)76-52(36(7)8)68(96)84-32-24-28-48(84)64(92)80-55(39(13)14)71(99)103-43(19)59(87)75-50(34(3)4)66(94)82-30-22-26-46(82)62(90)78-53(37(9)10)69(97)101-41(17)57(85)73-49/h33-56H,21-32H2,1-20H3,(H,73,85)(H,74,86)(H,75,87)(H,76,88)(H,77,89)(H,78,90)(H,79,91)(H,80,92)/t41-,42-,43-,44-,45+,46+,47+,48+,49-,50-,51-,52-,53+,54+,55+,56+/m1/s1
InChIKey HLCKHUOOUINDAS-AAXSBOKLSA-N
Instrument Name Varian CFT-20
Literature Reference T.A.BALASHOVA, L.A.FONINA, L.B.SENYAVINA, N.V.STAROVOITOVA, G.YA.AVOTIN,V.T.IVANOV, YU.A.OVCHINNIKOV (1984) Bioorganich.Khim.(Russ. Lang.): v.10, N4,437-458.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3