Esmeraldic acid
Molecular Formula:
C
30
H
22
N
4
O
5
InChI:
InChI=1/C30H22N4O5/c1-13-15-6-3-10-20-28(15)34(21-11-5-8-17(29(36)37)25(21)32-20)22-12-18(30(38)39)26-27(23(13)22)33-24-16(14(2)35)7-4-9-19(24)31-26/h3-14,32,35H,1-2H3,(H,36,37)(H,38,39)/f/h36,38H
InChIKey:
InChIKey=WTSDJSFJEHPIOD-GEMOIWNACI
SMILES:
CC1C2=C3C(=CC=C2)NC4=C(C=CC=C4N3C5=C1C6=NC7=C(C=CC=C7N=C6C(=C5)C(=O)O)C(C)O)C(=O)O
Names:
C12116
Esmeraldic acid
Registries:
PubChem CID 443632
PubChem ID 14263