equisetin
Chemical Formula:
C22H31NO4
Molecular Weight:
373.491 Daltons
Monoisotopic Mass:
373.22530848869997 Daltons
SMILES:
CC=CC3(C(C)(C(O)=C1(C(=O)C(CO)N(C)C(=O)1))[CH]2([CH](CC(C)CC2)C=C3))
InChI:
1S/C22H31NO4/c1-5-6-15-9-8-14-11-13(2)7-10-16(14)22(15,3)20(26)18-19(25)17(12-24)23(4)21(18)27/h5-6,8-9,13-17,24,26H,7,10-12H2,1-4H3/b6-5+,20-18-/t13-,14-,15-,16-,17+,22-/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-17992
ChemSpider:
4572316
PubChem (CID):
54679016
MetaNetX:
MNXM149041
ChEBI:
142135