Cas no 313054-32-9 ((25R)-spirost-5-en-3β,17α-diol 3-O-[2''-OAc-α-L-rhamnopyranosyl-(1→2)]-β-D-xylopyranosyl-(1→3)-β-D-glucopyranoside)

(25R)-spirost-5-en-3β,17α-diol 3-O-[2''-OAc-α-L-rhamnopyranosyl-(1→2)]-β-D-xylopyranosyl-(1→3)-β-D-glucopyranoside structure
313054-32-9 structure
Product Name:(25R)-spirost-5-en-3β,17α-diol 3-O-[2''-OAc-α-L-rhamnopyranosyl-(1→2)]-β-D-xylopyranosyl-(1→3)-β-D-glucopyranoside
CAS No:313054-32-9
MF:C46H72O18
MW:912.47200
CID:4643861
PubChem ID:154831924
Update Time:2024-10-31

(25R)-spirost-5-en-3β,17α-diol 3-O-[2''-OAc-α-L-rhamnopyranosyl-(1→2)]-β-D-xylopyranosyl-(1→3)-β-D-glucopyranoside Chemical and Physical Properties

Names and Identifiers

    • Ophiopojaponin A
    • Pennogenin 3-O-[2'-O-acetyl-alpha-L-rhamnopyranosyl-(1→2)]-beta-D-xylopyranosyl-(1→3)-beta-D-glucopyranoside
    • Deacetyl ophiopojaponin A
    • (3β,25R)-17-Hydroxyspirost-5-en-3-yl 2-O-acetyl-6-deoxy-α-L-mannopyranosyl-(1->2)-[β-D-xylopyranosyl
    • 2-[4-Hydroxy-6-(hydroxymethyl)-2-[(1R,4S,6R,8S,9S,12S,13R)-8-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl]oxy-5-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol
    • 313054-32-9
    • (25R)-spirost-5-en-3β,17α-diol 3-O-[2''-OAc-α-L-rhamnopyranosyl-(1→2)]-β-D-xylopyranosyl-(1→3)-β-D-glucopyranoside
    • Inchi： 1S/C46H72O18/c1-20-9-14-45(57-18-20)22(3)46(55)31(64-45)16-28-26-8-7-24-15-25(10-12-43(24,5)27(26)11-13-44(28,46)6)60-42-39(63-41-38(59-23(4)48)35(53)32(50)21(2)58-41)37(34(52)30(17-47)61-42)62-40-36(54)33(51)29(49)19-56-40/h7,20-22,25-42,47,49-55H,8-19H2,1-6H3/t20-,21+,22-,25+,26-,27+,28+,29-,30-,31+,32+,33+,34-,35-,36-,37+,38-,39-,40+,41+,42-,43+,44+,45-,46-/m1/s1
    • InChI Key： LERALCVLYDPIAD-VSGHBKQDSA-N
    • SMILES： O[C@]12[C@H](C)[C@]3(OC[C@H](C)CC3)O[C@@]1([H])C[C@@]1([H])[C@]3([H])CC=C4C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]21C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1OC(=O)C

Computed Properties

  • Exact Mass: 870.46130076g/mol
  • Monoisotopic Mass: 870.46130076g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 9
  • Hydrogen Bond Acceptor Count: 17
  • Heavy Atom Count: 61
  • Rotatable Bond Count: 7
  • Complexity: 1620
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 7
  • Undefined Atom Stereocenter Count : 18
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -0.3
  • Topological Polar Surface Area: 256?2

Experimental Properties

  • Density: 1.42±0.1 g/cm3 (20 oC 760 Torr),
  • Solubility: Insuluble (3.4E-3 g/L) (25 oC),

(25R)-spirost-5-en-3β,17α-diol 3-O-[2''-OAc-α-L-rhamnopyranosyl-(1→2)]-β-D-xylopyranosyl-(1→3)-β-D-glucopyranoside 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
BZP1131-10mg
(25R)-spirost-5-en-3β,17α-diol 3-O-[2''-OAc-α-L-rhamnopyranosyl-(1→2)]-β-D-xylopyranosyl-(1→3)-β-D-glucopyranoside
 313054-32-9 HPLC≥98%
10mg
 ￥2820元 2023-09-15

(25R)-spirost-5-en-3β,17α-diol 3-O-[2''-OAc-α-L-rhamnopyranosyl-(1→2)]-β-D-xylopyranosyl-(1→3)-β-D-glucopyranoside Related Literature

Related Categories

313054-32-9 ((25R)-spirost-5-en-3β,17α-diol 3-O-[2''-OAc-α-L-rhamnopyranosyl-(1→2)]-β-D-xylopyranosyl-(1→3)-β-D-glucopyranoside) Related Products

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