Cas no 91653-50-8 (Zingiberen Newsaponin)

Zingiberen Newsaponin is a bioactive compound derived from ginger (Zingiber officinale), characterized by its unique combination of zingiberene, a sesquiterpene, and saponin glycosides. This compound exhibits notable anti-inflammatory and antioxidant properties, making it valuable in pharmaceutical and nutraceutical applications. Its molecular structure enhances bioavailability, allowing for efficient cellular uptake and metabolic activity. Studies suggest potential benefits in modulating immune responses and reducing oxidative stress. Zingiberen Newsaponin is also investigated for its synergistic effects with other bioactive agents, improving therapeutic efficacy. Its stability under varying pH conditions and thermal processing further underscores its suitability for formulation in diverse delivery systems. Research continues to explore its mechanistic pathways and broader applications.
Zingiberen Newsaponin structure
Zingiberen Newsaponin structure
Product Name:Zingiberen Newsaponin
CAS No:91653-50-8
MF:C51H82O22
MW:1047.18359899521
CID:805676
PubChem ID:102475150
Update Time:2025-07-02

Zingiberen Newsaponin Chemical and Physical Properties

Names and Identifiers

    • Zingiberensis saponin I
    • b-D-Glucopyranoside, (3b,25R)-spirost-5-en-3-yl O-b-D-glucopyranosyl-(1&reg
    • 3)-O-b-D-glucopyranosyl-(1&reg
    • 3-O-β-D-Glucopyranosyl(1→3)-β-D-glucopyranosyl(1→4)-[α-L-rhamnopyranosyl(1→2)]-β-D-glucopyranoside-diosgenin
    • Diosgenin 3-O--D-Glucopyranosyl-(13)--D-glucopyranosyl-(14)-[-L-rhamnopyranosyl-(12)]--D-glucopyra
    • Spiro[8H-naphth[2',1':4,5]indeno[2,1-b]furan-8,2'-[2H]pyran], β-D-glucopyranoside deriv.
    • Zingiberennewsaponin
    • Zingiberensis newsaponin
    • 2-[5-[3,5-Dihydroxy-6-(hydroxymethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]ox
    • (3β,25R)-Spirost-5-en-3-yl O-β-D-glucopyranosyl-(1→3)-O-β-D-glucopyranosyl-(1→4)-O-[6-deoxy-α-L-mannopyranosyl-(1→2)]-β-D-glucopyranoside (ACI)
    • Spiro[8H-naphth[2′,1′:4,5]indeno[2,1-b]furan-8,2′-[2H]pyran], β-D-glucopyranoside deriv. (ZCI)
    • Spirostan, β-D-glucopyranoside deriv. (ZCI)
    • β-D-Glucopyranoside, (3β,25R)-spirost-5-en-3-yl O-6-deoxy-α-L-mannopyranosyl-(1→2)-O-[O-β-D-glucopyranosyl-(1→3)-β-D-glucopyranosyl-(1→4)]- (ZCI)
    • 3-O-β-D-Glucopyranosyl-(1→3)-β-D-glucopyranosyl-(1→4)-[α-L-rhamnopyranosyl-(1→2)]-β-D-glucopyranosyldiosgenin
    • Diosgenin 3-O-β-D-Glucopyranosyl-(1→3)-β-D-glucopyranosyl-(1→4)-[α-L-rhamnopyranosyl-(1→2)]-β-D-glucopyranoside
    • Spirost-5-en-3-yl β-D-glucopyranosyl(1→3)-β-D-glucopyranosyl (1→4)-[α-L-rhamnopyranosyl(1→2)]-β-D-glucopyranoside
    • Zingiberen Newsaponin
    • Zingiberenis newsaponin
    • CS-0019611
    • E88668
    • 3-O-.BETA.-D-GLUCOPYRANOSYL(1->3)-.BETA.-D-GLUCOPYRANOSYL(1->4)-(.ALPHA.-L-RHAMNOPYRANOSYL(1->2))-.BETA.-D-GLUCOPYRANOSIDE-DIOSGENIN
    • beta-D-Glucopyranoside, (3beta,25R)-spirost-5-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1-2)-O-(O-beta-D-glucopyranosyl-(1-3)-beta-D-glucopyranosyl-(1-4))-, (S-(R*,R*))-
    • AKOS040760768
    • 91653-50-8
    • HY-N2282
    • N7TJ111YCJ
    • Deltonin glucoside
    • MS-31895
    • UNII-N7TJ111YCJ
    • .BETA.-D-GLUCOPYRANOSIDE, (3.BETA.,25R)-SPIROST-5-EN-3-YL O-.BETA.-D-GLUCOPYRANOSYL-(1->3)-O-.BETA.-D-GLUCOPYRANOSYL-(1->4)-O-(6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL-(1->2))-
    • AKOS037515207
    • FT-0775905
    • 2-[5-[3,5-dihydroxy-6-(hydroxymethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)-2-(5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl)oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol
    • BETA-D-GLUCOPYRANOSIDE, (3BETA,25R)-SPIROST-5-EN-3-YL O-BETA-D-GLUCOPYRANOSYL-(1->3)-O-BETA-D-GLUCOPYRANOSYL-(1->4)-O-(6-DEOXY-ALPHA-L-MANNOPYRANOSYL-(1->2))-
    • 3-O-BETA-D-GLUCOPYRANOSYL(1->3)-BETA-D-GLUCOPYRANOSYL(1->4)-(ALPHA-L-RHAMNOPYRANOSYL(1->2))-BETA-D-GLUCOPYRANOSIDE-DIOSGENIN
    • beta-D-Glucopyranoside, (3 beta,25R)-spirost-5-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1-2)-O-(O-beta-D-glucopyranosyl-(1-3)-beta-D-glucopyranosyl-(1-4))-, (S-(R*,R*))-
    • DTXSID00919608
    • Inchi: 1S/C51H82O22/c1-20-8-13-51(64-19-20)21(2)32-28(73-51)15-27-25-7-6-23-14-24(9-11-49(23,4)26(25)10-12-50(27,32)5)66-48-44(72-45-38(60)36(58)33(55)22(3)65-45)40(62)42(31(18-54)69-48)70-47-41(63)43(35(57)30(17-53)68-47)71-46-39(61)37(59)34(56)29(16-52)67-46/h6,20-22,24-48,52-63H,7-19H2,1-5H3/t20-,21+,22+,24+,25-,26+,27+,28+,29-,30-,31-,32+,33+,34-,35-,36-,37+,38-,39-,40+,41-,42-,43+,44-,45+,46+,47+,48-,49+,50+,51-/m1/s1
    • InChI Key: XJOTXMLDNWCDRH-HAUZKCKMSA-N
    • SMILES: C[C@]12CC[C@@H]3[C@]4(CC[C@H](O[C@@H]5O[C@H](CO)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O[C@H]7[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O7)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)CC4=CC[C@H]3[C@@H]1C[C@@H]1O[C@@]3(OC[C@H](C)CC3)[C@H]([C@H]21)C)C

Computed Properties

  • Exact Mass: 1046.53000
  • Monoisotopic Mass: 1046.529774
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 12
  • Hydrogen Bond Acceptor Count: 22
  • Heavy Atom Count: 73
  • Rotatable Bond Count: 11
  • Complexity: 1940
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 31
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Molecular Weight: 1047.2
  • XLogP3: -0.8
  • Topological Polar Surface Area: 335

Experimental Properties

  • Color/Form: Powder
  • Density: 1.48±0.1 g/cm3 (20 oC 760 Torr),
  • Melting Point: 285-287 oC (methanol )
  • Boiling Point: °Cat760mmHg
  • Flash Point: °C
  • Refractive Index: 1.637
  • Solubility: Insuluble (1.0E-3 g/L) (25 oC),
  • PSA: 335.06000
  • LogP: -1.96170

Zingiberen Newsaponin Pricemore >>

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