![CYCLO[-(D-VAL-L-PRO-L-VAL-D-HYI)3-]](/api/spectrum/FRnaNduVNwt/structure.png?h=300&w=458 "CYCLO[-(D-VAL-L-PRO-L-VAL-D-HYI)3-]")
| SpectraBase Compound ID | 1mjslExaHoy |
|---|---|
| InChI | InChI=1S/C60H99N9O15/c1-28(2)40-55(76)67-25-19-22-37(67)49(70)64-44(32(9)10)59(80)83-47(35(15)16)53(74)62-42(30(5)6)57(78)69-27-21-24-39(69)51(72)66-45(33(11)12)60(81)84-48(36(17)18)54(75)63-41(29(3)4)56(77)68-26-20-23-38(68)50(71)65-43(31(7)8)58(79)82-46(34(13)14)52(73)61-40/h28-48H,19-27H2,1-18H3,(H,61,73)(H,62,74)(H,63,75)(H,64,70)(H,65,71)(H,66,72)/t37-,38-,39-,40+,41+,42+,43-,44-,45-,46+,47+,48+/m1/s1 |
| InChIKey | ODKNWKBFRJHMJD-IMFQXZCISA-N |
| Mol Weight | 1186.5 g/mol |
| Molecular Formula | C60H99N9O15 |
| Exact Mass | 1185.726064 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FRnaNduVNwt |
|---|---|
| Name | CYCLO[-(D-VAL-L-PRO-L-VAL-D-HYI)3-] |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C60H99N9O15 |
| InChI | InChI=1S/C60H99N9O15/c1-28(2)40-55(76)67-25-19-22-37(67)49(70)64-44(32(9)10)59(80)83-47(35(15)16)53(74)62-42(30(5)6)57(78)69-27-21-24-39(69)51(72)66-45(33(11)12)60(81)84-48(36(17)18)54(75)63-41(29(3)4)56(77)68-26-20-23-38(68)50(71)65-43(31(7)8)58(79)82-46(34(13)14)52(73)61-40/h28-48H,19-27H2,1-18H3,(H,61,73)(H,62,74)(H,63,75)(H,64,70)(H,65,71)(H,66,72)/t37-,38-,39-,40+,41+,42+,43-,44-,45-,46+,47+,48+/m1/s1 |
| InChIKey | ODKNWKBFRJHMJD-IMFQXZCISA-N |
| Instrument Name | Varian XL-100 |
| Literature Reference | T.A.BALASHOVA, L.A.FONINA, A.Z.GUREVICH, N.V.STAROVOITOVA, L.B.SENYAVINA,G.YA.AVOTIN, V.T.IVANOV, YU.A.OVCHINNIKOV (1983) Bioorganich.Khim.(Russ.Lang.): v.9, N7, 883-899. |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |