heliocide B3
Chemical Formula:
C26H31O5
Molecular Weight:
423.528 Daltons
Monoisotopic Mass:
424.2249741377 Daltons
SMILES:
CC(=CCCC2(CC1(C(C3(=C(C(C1CC=2)=O)C(=C(C(=C3C(C)C)OC)[O-])C=O))=O)(C)))C
InChI:
1S/C26H32O5/c1-14(2)8-7-9-16-10-11-18-23(29)20-17(13-27)22(28)24(31-6)19(15(3)4)21(20)25(30)26(18,5)12-16/h8,10,13,15,18,28H,7,9,11-12H2,1-6H3/p-1
InChIKey:
Databases
MetaCyc:
CPD-9747
PubChem (CID):
25200598
Seed:
cpd25817
MetaNetX:
MNXM18315