CHEBI:119210 - LSM-30659

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-30659
ChEBI ID CHEBI:119210
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C34H40N4O5
Net Charge 0
Average Mass 584.706
Monoisotopic Mass 584.29987
InChI InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-12-8-9-13-29(28)37(32)4)27-11-7-6-10-24(27)21-43-30(22)19-36(3)34(41)35-25-14-16-26(42-5)17-15-25/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30+/m0/s1
InChIKey VWHOEYJBVKWJDQ-DDFCPOBKSA-N
SMILES C[C@H]1CN(C(=O)C2=C(C3=CC=CC=C3CO[C@@H]1CN(C)C(=O)NC4=CC=C(C=C4)OC)C5=CC=CC=C5N2C)[C@H](C)CO
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing LSM-30659 (CHEBI:119210) is a indolyl carboxylic acid (CHEBI:46867)
Manual Xref Database
LSM-30659 LINCS
View more database links