Cas no 111843-08-4 (Spirost-5-ene-3,24-diol,(3b,24R,25R)- (9CI))

Spirost-5-ene-3,24-diol,(3b,24R,25R)- (9CI) structure
111843-08-4 structure
Product Name:Spirost-5-ene-3,24-diol,(3b,24R,25R)- (9CI)
CAS No:111843-08-4
MF:C27H42O4
MW:430.619988918304
CID:162254
Update Time:2024-03-01

Spirost-5-ene-3,24-diol,(3b,24R,25R)- (9CI) Chemical and Physical Properties

Names and Identifiers

    • Spirost-5-ene-3,24-diol,(3b,24R,25R)- (9CI)
    • Spiro[8H-naphth[2',1':4,5]indeno[2,1-b]furan-8,2'-[2H]pyran],spirost-5-ene-3,24-diol deriv.
    • Zingiberogenin
    • Spirost-5-ene-3,24-diol, (3β,24R,25R)-
    • Inchi： 1S/C27H42O4/c1-15-14-30-27(13-22(15)29)16(2)24-23(31-27)12-21-19-6-5-17-11-18(28)7-9-25(17,3)20(19)8-10-26(21,24)4/h5,15-16,18-24,28-29H,6-14H2,1-4H3/t15-,16+,18+,19-,20+,21+,22-,23+,24+,25+,26+,27-/m1/s1
    • InChI Key： CXNFKXVHWOMKSS-UFUSWZLMSA-N
    • SMILES： [C@@H]1(O)CC2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@]1([C@H](C)[C@@]4(C[C@@H](O)[C@H](C)CO4)O[C@@]1([H])C3)[H])CC=2

Computed Properties

  • Exact Mass: 272.08309

Experimental Properties

  • Density: 1.18±0.1 g/cm3(Predicted)
  • Boiling Point: 575.6±50.0 °C(Predicted)
  • PSA: 52.54
  • pka: 14.50±0.70(Predicted)

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