CAS: 97169-13-6 - β,β-Caroten-4-one, 3,3′,4′-trihydroxy-, (3S,3′S,4′R)-

Formula: C₄₀H₅₄O₄

InChI: InChI=1S/C40H54O4/c1-27(17-13-19-29(3)21-23-33-31(5)37(43)35(41)25-39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)38(44)36(42)26-40(34,9)10/h11-24,35-37,41-43H,25-26H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,27-15+,28-16+,29-19+,30-20+/t35-,36-,37+/m0/s1

InChI key: InChIKey=DNKQGUYVWUAYIE-KRJZFOBGSA-N

SMILES: O=C1C(=C(C=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC2=C(C)C(O)C(O)CC2(C)C)C)C)C)C)C(C)(C)CC1O)C

Synonyms:

• β,β-Caroten-4-one, 3,3′,4′-trihydroxy-, (3S,3′S,4′R)-
• (3S,3′S,4′R)-Idoxanthin

(3S,3'S,4'R)-Idoxanthin

CAS: 97169-13-6

• Formula: C₄₀H₅₄O₄
• Color and Shape: Neat
• Molecular weight: 598.854