Dataset

Ameriviroidin[6]

Chemical Information

InChI	InChI=1S/C38H58N8O16S.C2H6/c1-16(2)26-34(57)45-27(18(4)50)35(58)42-24(13-47)33(56)46-28(29(52)25(51)14-48)36(59)39-17(3)30(53)40-22(31(54)41-23(32(55)44-26)12-38(5,60)15-49)11-20-19-9-7-8-10-21(19)43-37(20)63(6,61)62;1-2/h7-10,16-18,22-29,43,47-52,60H,11-15H2,1-6H3,(H,39,59)(H,40,53)(H,41,54)(H,42,58)(H,44,55)(H,45,57)(H,46,56);1-2H3/t17-,18-,22-,23-,24+,25+,26-,27+,28-,29-,38+;/m0./s1
SMILES	CC.CC(C)[C@@H]1NC(=O)[C@H](C[C@@](C)(O)CO)NC(=O)[C@H](CC2=C(S(C)(=O)=O)NC3=C2C=CC=C3)NC(=O)[C@H](C)NC(=O)[C@H]([C@@H](O)[C@H](O)CO)NC(=O)[C@@H](CO)NC(=O)[C@@H]([C@H](C)O)NC1=O
InChI Key	CBIUSAIRVZXXNR-ZZXCQYDZSA-N

Data and Resources

• Ameriviroidin[6]HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.57992/nmrxiv.p143.s1401.d6221
License URL	https://creativecommons.org/licenses/by/4.0/legalcode
Source	https://nmrxiv.org/D6221
Version
Author
Maintainer
Language	english
MetadataPublished	2025-10-23T07:00:00.000000Z
Related Molecule

Field	Value
Measurement Technique	rotating frame Overhauser effect spectroscopy
Measurement Variables	NMR solvent : DMSO acquisition nucleus : ['1H', '1H'] NMR spectrum by dimensionality : 2 NMR probe : Z168766_0001 (CP2.1 TXO 700S4 C/N-H-D-05 Z XT) Temperature : 358.0008 K magnetic field strength : 16.414076707401964 Tesla number of scans : 16 scans nuclear magnetic resonance pulse sequence : roesyphpp.2 Spectral Width : [13.7583775353978, 13.7583775353978] number of data points : [4096, 256] points relaxation time measurement : 1.3 seconds

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.