(3S,3'R,6'S)-β,ε-Carotene-3,3'-diol


CAS No. : 105452-20-8

 (3S,3
Product Details
Cat No:M002795
Molecular Formula:C40H56O2
Molecular Weight:568.886
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Cat No:M002795
Cas No:105452-20-8
Product-Name: (3S,3'R,6'S)-β,ε-Carotene-3,3'-diol
IUPAC Name:(1S)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(1S,4R)-4-hydroxy-2,6,6-trimethylcyclohex-2-en-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-3,5,5-trimethylcyclohex-3-en-1-ol
InChI:InChI=1S/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-25,35-37,41-42H,26-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36-,37+/m0/s1
InChIKey:KBPHJBAIARWVSC-XWUGOPFFSA-N
SMILES:CC1=C(C(CC(C1)O)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2C(=CC(CC2(C)C)O)C)C)C
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