SEQ2FUN

BioLiP

PDB CCD ID: NCM
Number of entries in BioLiP: 1
Chemical formula: C7 H10 O
InChI: InChI=1S/C7H10O/c8-7-4-5-1-2-6(7)3-5/h5-6H,1-4H2/t5-,6+/m0/s1
InChIKey: KPMKEVXVVHNIEY-NTSWFWBYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0C1CC2CC1CC2=O
CACTVS 3.341O=C1C[CH]2CC[CH]1C2
ACDLabs 10.04O=C1CC2CC1CC2
CACTVS 3.341O=C1C[C@H]2CC[C@@H]1C2
OpenEye OEToolkits 1.5.0C1C[C@@H]2C[C@H]1CC2=O
Name:NORCAMPHOR
DrugBank: DB03540
ZINC: ZINC000001693941
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).