Dataset

1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

dataset for 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C25H34N4O7/c1-3-14(2)21-25(36)29-12-4-5-19(29)24(35)26-17(10-11-20(31)32)22(33)27-18(23(34)28-21)13-15-6-8-16(30)9-7-15/h6-9,14,17-19,21,30H,3-5,10-13H2,1-2H3,(H,26,35)(H,27,33)(H,28,34)(H,31,32)/t14?,17-,18-,19+,21-/m0/s1
SMILES CCC([C@@H]1NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@@H](NC(=O)[C@@H]2N(C1=O)CCC2)CCC(=O)O)C
InChI Key XKOXVLDNALOEPV-OPFZVLEESA-N
Molecular Formula C25H34N4O7
Exact Mass 502.560 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/XKOXVLDNALOEPV-OPFZVLEESA-N/CHMO0001146
License URL
Source https://www.chemotion-repository.net/inchikey/XKOXVLDNALOEPV-OPFZVLEESA-N/CHMO0001146
Version
Author Claudine Herlan
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T03:20:02.851802
MetadataModified 2024-09-07T18:11:35.462258
MetadataPublished 2020-06-12
Field Value
Measurement Technique 1H–13C heteronuclear single quantum coherence
Measurement Variables
Data-Source Molecule ID Data-Source
146170772 PubChem
The data in this table is sourced from UniChem at EBI.