demethylspheroidene
Chemical Formula:
C40H58O
Molecular Weight:
554.898 Daltons
Monoisotopic Mass:
554.4487664839 Daltons
SMILES:
CC(=CCCC(=CC=CC(=CC=CC(=CC=CC=C(C=CC=C(CCC=C(C=CCC(O)(C)C)C)C)C)C)C)C)C
InChI:
1S/C40H58O/c1-33(2)19-13-22-36(5)25-16-28-37(6)26-14-23-34(3)20-11-12-21-35(4)24-15-27-38(7)29-17-30-39(8)31-18-32-40(9,10)41/h11-12,14-16,18-21,23-28,30-31,41H,13,17,22,29,32H2,1-10H3/b12-11+,23-14+,24-15+,28-16+,31-18+,34-20+,35-21+,36-25+,37-26+,38-27+,39-30+
InChIKey:
Databases
MetaCyc:
CPD-11464
PubChem (CID):
131841598
ChemSpider:
17220922
ChEBI:
62505
KEGG:
C15898
Seed:
cpd14628
MetaNetX:
MNXM2815