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Substance Name: Dinoxanthin
RN: 54369-12-9
InChIKey: PVNVIBOWBAPFOE-CQZDCAQOSA-N

Molecular Weight

  • 642.915
 
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Names and Synonyms

  • Dinoxanthin

Registry Numbers

CAS Registry Number

  • 54369-12-9

System Generated Number

  • 0054369129

Structure Descriptors

InChI

1S/C42H58O5/c1-30(18-14-20-32(3)22-23-37-38(6,7)28-36(46-34(5)43)29-40(37,10)45)16-12-13-17-31(2)19-15-21-33(4)24-25-42-39(8,9)26-35(44)27-41(42,11)47-42/h12-22,24-25,35-36,44-45H,26-29H2,1-11H3/b13-12+,18-14+,19-15+,25-24+,30-16+,31-17+,32-20+,33-21+/t23?,35-,36-,40+,41+,42-/m0/s1

InChIKey

PVNVIBOWBAPFOE-CQZDCAQOSA-N

Smiles

C1([C@]2([C@](C[C@H](C1)O)(C)O2)\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@H](CC1(C)C)OC(C)=O)(C)O)C)(C)C