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Details

Stereochemistry ABSOLUTE
Molecular Formula C40H56O
Molecular Weight 552.872
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 10
Charge 0

SHOW SMILES / InChI
Structure of RUBIXANTHIN

SMILES

CC(C)=CCC\C(C)=C\C=C\C(C)=C\C=C\C(C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\C1=C(C)C[C@@H](O)CC1(C)C

InChI

InChIKey=ABTRFGSPYXCGMR-AXXBKCDFSA-N
InChI=1S/C40H56O/c1-31(2)17-13-20-34(5)23-15-25-35(6)24-14-21-32(3)18-11-12-19-33(4)22-16-26-36(7)27-28-39-37(8)29-38(41)30-40(39,9)10/h11-12,14-19,21-28,38,41H,13,20,29-30H2,1-10H3/b12-11+,21-14+,22-16+,25-15+,28-27+,32-18+,33-19+,34-23+,35-24+,36-26+/t38-/m1/s1

HIDE SMILES / InChI

Molecular Formula C40H56O
Molecular Weight 552.872
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 10
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
0PWJ89032Q
Record Status Validated (UNII)
Record Version