3,20-dimethyl-1,2,21,22-tetradehydro-2,3,20,21-tetrahydrobotryococcene

Chemical Formula:

C₃₂H₅₄

Molecular Weight:

438.779 Daltons

Monoisotopic Mass:

438.4225517334 Daltons

SMILES:

C=CC(C)(C=CC(C)CCC=C(C)CCC(C(=C)C)C)CCC=C(C)CCC(C)C(=C)C

InChI:

1S/C32H54/c1-12-32(11,23-14-17-28(7)19-21-31(10)26(4)5)24-22-29(8)16-13-15-27(6)18-20-30(9)25(2)3/h12,15,17,22,24,29-31H,1-2,4,13-14,16,18-21,23H2,3,5-11H3/b24-22+,27-15+,28-17+

InChIKey:

YIERDWVPDSIPLW-PTFXNVDKSA-N

Synonyms

dimethylbotryococcene

Databases

MetaCyc: CPD-14262

PubChem (CID): 14274988

MetaboLights: MTBLC70865

ChEBI: 70865

Seed: cpd24257

MetaNetX: MNXM97028

KEGG: C20435