Cas no 5866-30-8 (Nimbinic Acid)

Nimbinic Acid structure
Nimbinic Acid structure
Product Name:Nimbinic Acid
CAS No:5866-30-8
MF:C27H32O8
MW:484.538188934326
CID:1063953
PubChem ID:417485
Update Time:2025-07-11

Nimbinic Acid Chemical and Physical Properties

Names and Identifiers

    • Nimbinic Acid
    • [(2R,3aR,5R,5aR)-2-(3-Furyl)-5-hydroxy-6-(methoxycarbonyl)-1,6,9a ,10a-tetramethyl-9-oxo-3,3a,4a,5,5a,6,9,9a,10,10a-decahydro-2H-cy clopenta[b]naphtho[2,3-d]furan-10-yl]acetic acid
    • CHEMBL2008078
    • 5866-30-8
    • [2-(3-furyl)-5-hydroxy-6-(methoxycarbonyl)-1,6,9a,10a-tetramethyl-9-oxo-3,3a,4a,5,5a,6,9,9a,10,10a-decahydro-2H-cyclopenta[b]naphtho[2,3-d]furan-10-yl]acetic acid
    • 2-[13-(Furan-3-yl)-2-hydroxy-4-methoxycarbonyl-4,8,10,12-tetramethyl-7-oxo-16-oxatetracyclo[8.6.0.03,8.011,15]hexadeca-5,11-dien-9-yl]acetic acid
    • NCI60_042038
    • NSC92191
    • 2-(3-furyl-hydroxy-methoxycarbonyl-tetramethyl-oxo-[?]yl)acetic acid
    • (2R,3aR,4aS,5R,5aR,6R,9aR,10R,10aR)-2-(3-Furanyl)-3,3a,4a,5,5a,6,9,9a,10,10a-decahydro-5-hydroxy-6-(methoxycarbonyl)-1,6,9a,10a-tetramethyl-9-oxo-2H-cyclopenta[b]naphtho[2,3-d]furan-10-acetic Acid
    • Inchi: 1S/C27H32O8/c1-13-15(14-7-9-34-12-14)10-16-20(13)27(4)17(11-19(29)30)26(3)18(28)6-8-25(2,24(32)33-5)22(26)21(31)23(27)35-16/h6-9,12,15-17,21-23,31H,10-11H2,1-5H3,(H,29,30)
    • InChI Key: KGOYBAJIWVVEJU-UHFFFAOYSA-N
    • SMILES: O1C2CC(C3=COC=C3)C(C)=C2C2(C)C1C(C1C(C(=O)OC)(C)C=CC(C1(C)C2CC(=O)O)=O)O

Computed Properties

  • Exact Mass: 484.21000
  • Monoisotopic Mass: 484.20971797g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 35
  • Rotatable Bond Count: 5
  • Complexity: 1030
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 9
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.4
  • Topological Polar Surface Area: 123?2

Experimental Properties

  • PSA: 123.27000
  • LogP: 3.26320

Nimbinic Acid Pricemore >>

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Nimbinic Acid Production Method

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