sarcinaxanthin diglucoside

Chemical Formula:

C₆₂H₉₂O₁₂

Molecular Weight:

1029.402 Daltons

Monoisotopic Mass:

1028.6588784184 Daltons

SMILES:

CC(=CC=CC=C(C)C=CC=C(C)C=CC2(C(C)(C)C(CC=C(C)COC1(C(O)C(O)C(O)C(CO)O1))CCC(=C)2))C=CC=C(C)C=CC3(C(C)(C)C(CCC(=C)3)CC=C(C)COC4(OC(CO)C(O)C(O)C(O)4))

InChI:

1S/C62H92O12/c1-39(19-15-21-41(3)25-33-49-45(7)27-31-47(61(49,9)10)29-23-43(5)37-71-59-57(69)55(67)53(65)51(35-63)73-59)17-13-14-18-40(2)20-16-22-42(4)26-34-50-46(8)28-32-48(62(50,11)12)30-24-44(6)38-72-60-58(70)56(68)54(66)52(36-64)74-60/h13-26,33-34,47-60,63-70H,7-8,27-32,35-38H2,1-6,9-12H3/b14-13+,19-15+,20-16+,33-25+,34-26+,39-17+,40-18+,41-21+,42-22+,43-23+,44-24+/t47?,48?,49?,50?,51-,52-,53-,54-,55+,56+,57-,58-,59-,60-/m1/s1

InChIKey:

TXDSGKKRBUEIDQ-QAMRGFJISA-N

Synonyms

sarcinaxanthin di-β-D-glucoside

Databases

MetaCyc: CPD-20673

PubChem (CID): 131841441