Cas no 640-03-9 (b,b-Carotene-3,3'-diol, 5,6-epoxy-5,6-dihydro-,(3S,3'R,5R,6S)-)

b,b-Carotene-3,3'-diol, 5,6-epoxy-5,6-dihydro-,(3S,3'R,5R,6S)- structure
640-03-9 structure
Product Name:b,b-Carotene-3,3'-diol, 5,6-epoxy-5,6-dihydro-,(3S,3'R,5R,6S)-
CAS No:640-03-9
MF:C40H56O3
MW:584.870852470398
CID:518094
PubChem ID:5281223
Update Time:2025-07-01

b,b-Carotene-3,3'-diol, 5,6-epoxy-5,6-dihydro-,(3S,3'R,5R,6S)- Chemical and Physical Properties

Names and Identifiers

    • b,b-Carotene-3,3'-diol, 5,6-epoxy-5,6-dihydro-,(3S,3'R,5R,6S)-
    • (1R,3S,6S)-6-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(4R)-4-hydroxy-2,6,6-trimethylcyclohexen-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-1,5,5-trimethyl-7-oxabicyclo[4.1.0]hepta
    • ANTHERAXANTHIN(SH)
    • ANTHERAXANTHIN, trans-(AS) (In Solution)
    • ANTHERAXANTHIN, trans-(AS) (In Solution) PrintBack
    • (1R,3S,6S)-6-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(4R)-4-hydroxy-2,6,6-trimethylcyclohexen-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-3-ol
    • Antheraxanthin
    • zeaxanthin monoepoxide
    • Spectrum5_000366
    • ALL-TRANS-ANTHERAXANTHIN A
    • 640-03-9
    • UNII-0306J2L3DV
    • 5,6-epoxy-5,6-dihydro-beta,beta-carotene-3,3'-diol
    • .BETA.-CAROTENE-3,3'-DIOL, 5,6-EPOXY-5,6-DIHYDRO-
    • (3R,3'S,5'R,6'S)-5',6' -DIHYDRO-5',6'-EPOXY-.BETA.,.BETA.-CAROTENE-3,3'-DIOL
    • Antheraxanthin A
    • DTXSID601015587
    • Q572404
    • C08579
    • 1ST159339
    • .beta.-Carotene-3,3'-diol, 5,6-epoxy-5,6-dihydro-, all-trans-
    • CHEBI:27867
    • QDL
    • NCGC00178026-01
    • beta,beta-Carotene-3,3'-diol, 5,6-epoxy-5,6-dihydro- (VAN)
    • BSPBio_003502
    • all-trans-antheraxanthin
    • (1R,3S,6S)-6-((1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-((4R)-4-HYDROXY-2,6,6-TRIMETHYLCYCLOHEXEN-1-YL)-3,7,12,16-TETRAMETHYLOCTADECA-1,3,5,7,9,11,13,15,17-NONAENYL)-1,5,5-TRIMETHYL-7-OXABICYCLO(4.1.0)HEPTAN-3-OL
    • 25494-44-4
    • SCHEMBL96300
    • 0306J2L3DV
    • LMPR01070262
    • (1R,3S,6S)-6-((1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-((R)-4-HYDROXY-2,6,6-TRIMETHYLCYCLOHEX-1-EN-1-YL)-3,7,12,16-TETRAMETHYLOCTADECA-1,3,5,7,9,11,13,15,17-NONAEN-1-YL)-1,5,5-TRIMETHYL-7-OXABICYCLO(4.1.0)HEPTAN-3-OL
    • CCG-38889
    • 5,6-EPOXY-5,6-DIHYDRO-.BETA.,.BETA.-CAROTENE-3,3'-DIOL
    • trans-Antheraxanthin
    • 68831-78-7
    • .BETA.,.BETA.-CAROTENE-3,3'-DIOL, 5,6-EPOXY-5,6-DIHYDRO-, (3S,3'R,5R,6S)-
    • (3R,3'S,5'R,6'S)-5',6'-dihydro-5',6'-epoxy-beta,beta-carotene-3,3'-diol
    • Antheraxanthin B
    • (3R,5R,6S,3'R)-zeaxanthin 5,6-epoxide
    • (3S,3'R,5S,6R)-5,6-Epoxy-5,6-dihydro-beta,beta-carotene-3,3'-diol
    • DTXCID601473838
    • (3R,3'S,5'R,6'S)-5',6'-DIHYDRO-5',6'-EPOXY-.BETA.,.BETA.-CAROTENE-3,3'-DIOL
    • BETA-CAROTENE-3,3'-DIOL, 5,6-EPOXY-5,6-DIHYDRO-
    • beta,beta-Carotene-3,3'-diol, 5,6-epoxy-5,6-dihydro-
    • BETA-CAROTENE-3,3'-DIOL, 5,6-EPOXY-5,6-DIHYDRO-, ALL-TRANS-
    • BETA,BETA-CAROTENE-3,3'-DIOL, 5,6-EPOXY-5,6-DIHYDRO-, (3S,3'R,5R,6S)-
    • beta,beta-Carotene-3,3'-diol, 5,6-epoxy-5,6-dihydro-(VAN)
    • Inchi： 1S/C40H56O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(42)28-39(40,10)43-40/h11-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,22-21+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35+,39-,40+/m1/s1
    • InChI Key： OFNSUWBAQRCHAV-OYQUVCAXSA-N
    • SMILES： O1[C@]2(C)C[C@H](CC(C)(C)[C@]12/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](CC1(C)C)O)/C)/C)O

Computed Properties

  • Exact Mass: 584.42300
  • Monoisotopic Mass: 584.422946
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 43
  • Rotatable Bond Count: 10
  • Complexity: 1330
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 9
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 53
  • XLogP3: 10.3

Experimental Properties

  • Density: 1.055
  • Boiling Point: 708.6°C at 760 mmHg
  • Flash Point: 382.4°C
  • Refractive Index: 1.597
  • PSA: 52.99000
  • LogP: 9.75860

b,b-Carotene-3,3'-diol, 5,6-epoxy-5,6-dihydro-,(3S,3'R,5R,6S)- Pricemore >>

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