Cas no 1897-26-3 (Akuammiline)

Akuammiline structure
Akuammiline structure
Product Name:Akuammiline
CAS No:1897-26-3
MF:C23H26N2O4
MW:394.463546276093
CID:837764
PubChem ID:131850432
Update Time:2025-04-19

Akuammiline Chemical and Physical Properties

Names and Identifiers

    • Akuammiline
    • 2,5-Bis(trifluoromethyl)-1,3,4-oxadiazole
    • (16R)-16-Methyl-lycopodan-5-on
    • (16R)-16-methyl-lycopodan-5-one
    • (16R)-17-Acetoxy-akuammilan-16-carbonsaeure-methylester
    • (16R)-17-acetoxy-akuammilane-16-carboxylic acid methyl ester
    • 12-methyloctahydro-5H,10H-7a,10b-propanopyrido[3,2,1-ij]quinolin-10-one
    • AC1L2RC2
    • LS-88384
    • Lycopodan-5-one, 15-methyl-, (15R)- (9CI)
    • [ "" ]
    • (16R)-17-Acetoxyakuammilan-16-carboxylic acid methyl ester
    • Akuammilan-17-oic acid, 16-[(acetyloxy)methyl]-, methyl ester
    • Akuammilan-16-carboxylic acid, 17-(acetyloxy)-, methyl ester, (16R)-
    • 1897-26-3
    • QBHALCZZZWCCLV-SYZQJQIISA-N
    • Methyl (19trans)-16-[(acetyloxy)methyl]akuammilan-17-oate #
    • 2H-2,7a-Methanoindolo[2,3-a]quinolizine-13-carboxylic acid, 13-[(acetyloxy)methyl]-3-ethylidene-1,3,4,6,7,12b-hexahydro-, methyl ester, (2S,3E,5S,7aS,12bS,13R)-
    • DA-50298
    • FS-9433
    • Methyl (1S,10S,12R,13E)-18-(acetyloxymethyl)-13-ethylidene-8,15-diazapentacyclo[10.5.1.01,9.02,7.010,15]octadeca-2,4,6,8-tetraene-18-carboxylate
    • Inchi: 1S/C23H26N2O4/c1-4-15-12-25-10-9-22-16-7-5-6-8-18(16)24-20(22)19(25)11-17(15)23(22,21(27)28-3)13-29-14(2)26/h4-8,17,19H,9-13H2,1-3H3
    • InChI Key: QBHALCZZZWCCLV-UHFFFAOYSA-N
    • SMILES: O=C(C)OCC1(C23C(C4N(CC2)CC(=CC)C1C4)=NC1C3=CC=CC=1)C(OC)=O

Computed Properties

  • Exact Mass: 394.18900
  • Monoisotopic Mass: 394.18925731g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 29
  • Rotatable Bond Count: 5
  • Complexity: 805
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 68.2?2
  • XLogP3: 0.657

Experimental Properties

  • Color/Form: Powder
  • PSA: 68.20000
  • LogP: 2.16060

Akuammiline Pricemore >>

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