Cas no 77-60-1 (Tigogenin)

Tigogenin structure
Tigogenin structure
Product Name:Tigogenin
CAS No:77-60-1
MF:C27H44O3
MW:416.636468887329
MDL:MFCD00067287
CID:34081
PubChem ID:99516
Update Time:2025-04-19

Tigogenin Chemical and Physical Properties

Names and Identifiers

    • (25R)-5a-Spirostan-3b-ol
    • (25R)-5-alpha-spirostan-3-beta-ol
    • (25R)-5.α.-Spirostan-3.β.-ol
    • (2aS,2'R,4S,5'R,6aS,6bS,8aS,8bR,9S,11aS,12aS,12bR)-5',6a,8a,9-Tetramethyldocosahydrospiro[naphtho[2',1':4,5]indeno[2,1-b]furan-10,2'-pyran]-4-ol
    • Tigogenin
    • Sisalagenin
    • Ticogenin
    • Trigonegenin B
    • Tsosarsasaprgein
    • (25R)-5alpha-Spirostan-3beta-ol
    • [ "" ]
    • 5-alpha-Spirostan-3-beta-ol
    • 4SMU15RR44
    • (5alpha,25R)-Spirostan-3beta-ol
    • 5,6-Di
    • AKOS016002078
    • CHEMBL43871
    • MFCD00067287
    • HY-N1403
    • 5,6-Dihydrodiosgenin
    • 5-epi-sarsasapogenin
    • DTXSID40903920
    • BRN 1293741
    • BS-18122
    • S5334
    • (3-beta,5-alpha,25R)-Spirostan-3-ol
    • 5-alpha-Spirostan-3-beta-ol, (25R)-
    • GMBQZIIUCVWOCD-MFRNJXNGSA-N
    • (1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,16S,18S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-ol
    • (3-beta,5alpha,25R)-spirostan-3-ol
    • Q-201833
    • 22-Isoallospirostan-3
    • Spirostan-3-ol, (3b,5a,25R)-
    • NSC-93754
    • TIGOGENIN 90%; (25R)-5-alpha-spirostan-3-beta-ol
    • (3beta,5alpha,25R)-spirostan-3-ol
    • NSC 93754
    • A-ol
    • (25R)-5.alpha.-Spirostan-3.beta.-ol
    • A865190
    • SCHEMBL330309
    • UNII-4SMU15RR44
    • CHEBI:9595
    • 5alpha-Spirostan-3beta-ol, (25R)-
    • TIGOGENIN [MI]
    • LMST01080009
    • Q27108442
    • Spirostan-3-ol, (3beta,5alpha,25R)-
    • CS-0016821
    • 77-60-1
    • C08914
    • (1'R,2R,2'S,4'S,5R,7'S,8'R,9'S,12'S,13'S,16'S,18'S)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0?,?.0?,?.0??,??]icosane]-16'-ol
    • EINECS 201-041-9
    • (2aS,4S,5'R,6aS,6bS,8aS,8bR,9S,10R,11aS,12aS,12bR)-5',6a,8a,9-Tetramethyldocosahydrospiro[naphtho[2',1':4,5]indeno[2,1-b]furan-10,2'-pyran]-4-ol
    • NS00041008
    • NSC1615
    • GMBQZIIUCVWOCD-UHFFFAOYSA-N
    • FT-0603331
    • AKOS032947789
    • Spirostan-3-ol,5.alpha.,25R)-
    • NSC231816
    • NSC93754
    • NSC232021
    • SCHEMBL330310
    • 5.beta.-Spirostan-3.beta.-ol, (25S)-
    • Spirostan-3-ol,5.beta.,25S)-
    • Spirostan-3-ol, (3.alpha.,5.beta.,25S)-
    • epi-Sarsasapogenin
    • 5.alpha.-Spirostan-3.beta.-ol, (25R)-
    • Spirostan-3-ol #
    • NSC-231816
    • NSC-1615
    • 5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-ol
    • LS-15214
    • NSC-232021
    • 3-Episarsasapogenin
    • 5a-Spirostan-3ss-ol; (25R)-5a-Spirostan-3ss-ol; Tigogenin; (25R)-5a-Spirostan-3ss-ol;
    • Spiro[8H-naphth[2',1':4,5]indeno[2,1-b]furan-8,2'-[2H]pyran], spirostan-3-ol deriv.
    • Spirostan-3-ol, (3.beta.,5.alpha.,25R)-
    • DA-58578
    • 5alpha-Spirostan-3beta-ol, (25R)-(8CI)
    • sarsasapogenin, (3beta,5alpha,25R)-isomer
    • Spiro(8H-naphth(2',1':4,5)indeno(2,1-b)furan-8,2'-(2H)pyran), spirostan-3-ol deriv.
    • (1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,16S,18S)-5',7,9,13-tetramethylspiro(5-oxapentacyclo(10.8.0.02,9.04,8.013,18)icosane-6,2'-oxane)-16-ol
    • NSC 93754; Ticogenin; (3ss,5a,25R)-Spirostan-3-ol;
    • DTXCID801331880
    • HY-N1403R
    • Tigogenin (Standard)
    • FT42775
    • MDL： MFCD00067287
    • Inchi： 1S/C27H44O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h16-24,28H,5-15H2,1-4H3/t16-,17+,18+,19+,20-,21+,22+,23+,24+,25+,26+,27-/m1/s1
    • InChI Key： GMBQZIIUCVWOCD-MFRNJXNGSA-N
    • SMILES： O1[C@]2(CC[C@@H](C)CO2)[C@@H](C)[C@H]2[C@@H]1C[C@H]1[C@@H]3CC[C@H]4C[C@H](CC[C@]4(C)[C@H]3CC[C@@]12C)O
    • BRN： 1293741

Computed Properties

  • Exact Mass: 416.32900
  • Monoisotopic Mass: 416.32904526 g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 30
  • Rotatable Bond Count: 0
  • Complexity: 694
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 12
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 38.7
  • Molecular Weight: 416.6
  • XLogP3: 6.5

Experimental Properties

  • Color/Form: Powder
  • Density: 1.0362 (rough estimate)
  • Melting Point: 202-204 oC
  • Boiling Point: 516.6 ℃ at 760 mmHg
  • Flash Point: 266.2 °C
  • Refractive Index: 1.4700 (estimate)
  • PSA: 38.69000
  • LogP: 5.79380
  • Specific Rotation: -68 o (c=0.8g/100ml, CHCl3)

Tigogenin Security Information

  • RTECS：WH1443500
  • Safety Term：2.3
  • Storage Condition：Keep it tightly closed. Store in a cool, dry place.

Tigogenin Customs Data

  • HS CODE：2932999099
  • Customs Data：

    China Customs Code:

    2932999099

    Overview:

    2932999099. Other heterocyclic compounds containing only oxygen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Tigogenin Pricemore >>

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