Molecule
Compound_1_YAC_1I_NMReDATA_MNova_OrigFIDs.1d
Compound_1_YAC_1I_NMReDATA_MNova_OrigFIDs.hsqc
Compound_1_YAC_1I_NMReDATA_MNova_OrigFIDs[30]
Compound_1_YAC_1I_NMReDATA_MNova_OrigFIDs[60]
Compound_1_YAC_1I_NMReDATA_MNova_OrigFIDs[80]
nfdi4chem-mol2341 (Unknown Molecule)
Chemical Information
| InChI | InChI=1S/C42H44O7/c1-24(2)17-19-28-34(46-5)23-35(47-6)36-30(21-32(48-41(28)36)26-13-9-7-10-14-26)37-39(44)29(20-18-25(3)4)42-38(40(37)45)31(43)22-33(49-42)27-15-11-8-12-16-27/h7-18,23,30,32-33,44-45H,19-22H2,1-6H3 |
|---|---|
| SMILES | COC1=CC(OC)=C2C(=C1CC=C(C)C)OC(C1=CC=CC=C1)CC2C1=C(O)C(CC=C(C)C)=C2OC(C3=CC=CC=C3)CC(=O)C2=C1O |
| InChI Key | LHMWSPKXZZITTJ-UHFFFAOYSA-N |
5 Related Dataset(s)
⌄
Metadata Information
| Field | Value |
|---|---|
| NFDI4Chem Molecule ID | nfdi4chem-mol2341 |
| Source | |
| Alternate Name |
| Field | Value |
|---|---|
| No additional information available for this Dataset. | |
| Data-Source Molecule ID | Data-Source |
|---|---|
| No additional information available for this Dataset. | |