Cas no 27994-11-2 (Cimigenoside)

Cimigenoside structure
Cimigenoside structure
Product Name:Cimigenoside
CAS No:27994-11-2
MF:C35H56O9
MW:620.813752174377
CID:273358
PubChem ID:16088242
Update Time:2025-04-19

Cimigenoside Chemical and Physical Properties

Names and Identifiers

    • b-D-Xylopyranoside, (3b,15a,16a,23R,24S)-16,23:16,24-diepoxy-15,25-dihydroxy-9,19-cyclolanostan-3-yl
    • b-D-Xylopyranoside, (3b,15a,16a,23R,24S)-16,23:16,24-diepoxy-15,25-dihydroxy-9,19-cyclolanosta...
    • CiMigenol 3-beta-D-xylopyranoside
    • cimigenol 3-O-β-D-xylopyranoside
    • CIMIGENOL XYLOSIDE
    • Cimigenoside
    • Cimigenol 3-O-β-D -xylpyranoside
    • Cimigenol-3-O-β-D-xylpyranoside
    • [ "" ]
    • CID 138114883
    • DSSTox_CID_13334
    • DSSTox_RID_79065
    • DSSTox_GSID_33334
    • Cimigenol 3-O-
    • A-D -xylpyranoside
    • Tox21_200929
    • Cimigenol 3-O-|A-D-xylpyranoside
    • Cimigenol-3-O-
    • .beta.-D-Xylopyranoside, (3.beta.,15.alpha.,16.alpha.,23R,24S)-16,23:16,24-diepoxy-15,25-dihydroxy-9,19-cyclolanostan-3-yl
    • Cimigenoside xyloside
    • DTXSID0033334
    • CIMIGENOL-3-O-beta-D-XYLOSIDE (24S) (CONSTITUENT OF BLACK COHOSH)
    • 1CW26VCP4H
    • cimigenol-3-O-beta-D-xylopyranoside
    • A-D-xylpyranoside
    • CHEBI:70246
    • Q27138585
    • CHEMBL218613
    • DTXCID101333859
    • (2S,3R,4S,5R)-2-[[(1S,2R,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22S)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]oxane-3,4,5-triol
    • CIMICIFUGOL XYLOSIDE
    • Cimigoside
    • CIMIGENOL-3-O-.BETA.-D-XYLOSIDE (24S) (CONSTITUENT OF BLACK COHOSH) [DSC]
    • AKOS030573698
    • CIMIGENOL 3-O-.BETA.-D-XYLOPYRANOSIDE
    • CAS-27994-11-2
    • UNII-1CW26VCP4H
    • 27994-11-2
    • NCGC00258483-01
    • beta-D-Xylopyranoside, (3beta,15alpha,16alpha,23R,24S)-16,23:16,24-diepoxy-15,25-dihydroxy-9,19-cyclolanostan-3-yl
    • 2-[[2-Hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]oxane-3,4,5-triol
    • SCHEMBL14207270
    • DA-62321
    • Inchi: 1S/C35H56O9/c1-17-14-19-26(30(4,5)40)44-35(43-19)25(17)31(6)12-13-34-16-33(34)11-10-22(42-27-24(38)23(37)18(36)15-41-27)29(2,3)20(33)8-9-21(34)32(31,7)28(35)39/h17-28,36-40H,8-16H2,1-7H3/t17-,18-,19-,20+,21+,22+,23+,24-,25-,26+,27+,28-,31-,32-,33-,34+,35+/m1/s1
    • InChI Key: BTPYUWOBZFGKAI-XYGBCAHESA-N
    • SMILES: O1[C@H]2[C@@H](C(C)(C)O)O[C@]31[C@@H]([C@]1(C)[C@@](C)([C@H]3[C@H](C)C2)CC[C@@]23C[C@]42CC[C@@H](C(C)(C)[C@@H]4CC[C@H]31)O[C@H]1[C@@H]([C@H]([C@@H](CO1)O)O)O)O

Computed Properties

  • Exact Mass: 620.39200
  • Monoisotopic Mass: 616.36113323 g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 9
  • Heavy Atom Count: 44
  • Rotatable Bond Count: 2
  • Complexity: 1300
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 10
  • Undefined Atom Stereocenter Count : 7
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.3
  • Topological Polar Surface Area: 130
  • Molecular Weight: 616.8

Experimental Properties

  • Color/Form: Powder
  • Melting Point: No data available
  • Boiling Point: No data available
  • Flash Point: No data available
  • PSA: 138.07000
  • LogP: 3.12140

Cimigenoside Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
HE FEI BO MEI SHENG WU KE JI YOU XIAN ZE REN GONG SI
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WU HAN AN JIE KAI Biomedical Technology Co., Ltd.
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