(13cis)-β,β-Carotene

ChemSpider ID: 8432151
Molecular Formula: C₄₀H₅₆
Average mass: 536.87262 Da
Monoisotopic mass: 536.438232 Da
Systematic name

(13cis)-β,β-Carotene
SMILES and InChIs

SMILES:

C(/C1=C(/CCCC1(C)C)C)=C\C(=C\C=C\C(=C/C=C/C=C(/C=C/C=C(/C=C/C2=C(\C)CCCC2(C)C)C)C)C)C Copied

Std. InChI:

InChI=1S/C40H56/c1-31(19-13-21-33(3)25-27-37-35(5)23-15-29-39(37,7)8)17-11-12-18-32(2)20-14-22-34(4)26-28-38-36(6)24-16-30-40(38,9)10/h11-14,17-22,25-28H,15-16,23-24,29-30H2,1-10H3/b12-11+,19-13+,20-14+,27-25+,28-26+,31-17-,32-18+,33-21+,34-22+ Copied

Std. InChIKey:

OENHQHLEOONYIE-MZMZTKINSA-N Copied
Cite this record
CSID:8432151, http://www.chemspider.com/Chemical-Structure.8432151.html (accessed 20:15, May 22, 2013) Copied

Names and Identifiers

Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

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