heliocide H3
Chemical Formula:
C25H29O5
Molecular Weight:
409.501 Daltons
Monoisotopic Mass:
410.2093240735 Daltons
SMILES:
CC(=CCCC2(CC1(C(C3(C(C(C1CC=2)=O)=C(C(=C(C=3C(C)C)O)[O-])C=O))=O)(C)))C
InChI:
1S/C25H30O5/c1-13(2)7-6-8-15-9-10-17-22(28)19-16(12-26)21(27)23(29)18(14(3)4)20(19)24(30)25(17,5)11-15/h7,9,12,14,17,27,29H,6,8,10-11H2,1-5H3/p-1
InChIKey:
Databases
MetaCyc:
CPD-9743
PubChem (CID):
25202994
Seed:
cpd25813
HMDB:
HMDB30741
MetaNetX:
MNXM18319