SEQ2FUN

FURNA

PDB CCD ID: 4PQ
Number of entries in FURNA: 1
Chemical formula: C11 H12 N2 O3
InChI: InChI=1S/C11H12N2O3/c12-9(11(15)16)3-6-5-13-10-2-1-7(14)4-8(6)10/h1-2,4-5,9,13-14H,3,12H2,(H,15,16)/t9-/m0/s1
InChIKey: LDCYZAJDBXYCGN-VIFPVBQESA-N
SMILES: N[CH](Cc1c[nH]c2ccc(O)cc12)C(O)=O;
NC(C(=O)O)Cc1cnc2ccc(cc12)O;
N[C@@H](Cc1c[nH]c2ccc(O)cc12)C(O)=O;
c1cc2c(cc1O)c(c[nH]2)C[C@@H](C(=O)O)N;
c1cc2c(cc1O)c(c[nH]2)CC(C(=O)O)N
Name:5-hydroxy-L-tryptophan;
Oxitriptan
ChEMBL: CHEMBL350221
DrugBank: DB02959
ZINC: ZINC000000895330

Reference:
  • Chengxin Zhang, Lydia Freddolino (2024) "FURNA: a database for function annotations of RNA structures," PLOS Biology 22(7): e3002476.