myxol

Chemical Formula:

C₄₀H₅₆O₃

Molecular Weight:

584.881 Daltons

Monoisotopic Mass:

584.4229456639 Daltons

SMILES:

CC(=CC=CC=C(C=CC=C(C=CC1(C(C)(C)CC(O)CC=1C))C)C)C=CC=C(C=CC=C(C=CC(O)C(O)(C)C)C)C

InChI:

1S/C40H56O3/c1-30(18-13-20-32(3)21-15-23-34(5)25-27-38(42)40(9,10)43)16-11-12-17-31(2)19-14-22-33(4)24-26-37-35(6)28-36(41)29-39(37,7)8/h11-27,36,38,41-43H,28-29H2,1-10H3/b12-11+,18-13+,19-14+,21-15+,26-24+,27-25+,30-16+,31-17+,32-20+,33-22+,34-23+

InChIKey:

JJPMVSRTRMLHST-KLGGLCJPSA-N

Synonyms

3',4'-didehydro-1',2'-dihydro-β,ψ-carotene-3,1',2'-triol

Databases

MetaCyc: CPD-11449

KEGG: C15919

PubChem (CID): 44237363

Seed: cpd14648

MetaNetX: MNXM4674

ChEBI: 80177