Cas no 74243-01-9 (7-Acetylintermedine)

7-Acetylintermedine structure
7-Acetylintermedine structure
Product Name:7-Acetylintermedine
CAS No:74243-01-9
MF:C17H27NO6
MW:341.399385690689
CID:571010
PubChem ID:3035235
Update Time:2025-04-19

7-Acetylintermedine Chemical and Physical Properties

Names and Identifiers

    • Butanoic acid,2,3-dihydroxy-2-(1-methylethyl)-,[(1R,7aR)-1-(acetyloxy)-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl]methyl ester,(2S,3R)-
    • 7-Acetylintermedine
    • 7-ACETYLLYCOPSAMINE
    • [(1R,7aR)-1-(acetyloxy)-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl]methyl (2S,3R)-2,3-dihydroxy-2-(propan-2-yl)butanoate
    • Butanoic acid, 2,3-dihydroxy-2-(1-methylethyl)-, ((1R,7aR)-1-(acetyloxy)-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl)methyl ester, (2S,3R)-
    • 74243-01-9
    • AKOS040758324
    • Butanoic acid, 2,3-dihydroxy-2-(1-methylethyl)-, (1-(acetyloxy)-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl)methyl ester, (1R-(1alpha,7(2S*,3R*),7abeta))-
    • 1ST167134
    • ((1R,7aR)-1-acetoxy-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl)methyl (2S,3R)-2,3-dihydroxy-2-isopropylbutanoate
    • HY-127011
    • NS00094176
    • Q27149735
    • Acetylintermedine
    • 7-O-Acetylintermedine , HPLC Grade
    • [(7R,8R)-7-acetyloxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2S)-2-hydroxy-2-[(1R)-1-hydroxyethyl]-3-methylbutanoate
    • MFCD31631254
    • CS-0091352
    • DTXSID201019870
    • CHEBI:80702
    • 7-O-Acetylintermedine
    • Inchi: 1S/C17H27NO6/c1-10(2)17(22,11(3)19)16(21)23-9-13-5-7-18-8-6-14(15(13)18)24-12(4)20/h5,10-11,14-15,19,22H,6-9H2,1-4H3/t11-,14-,15-,17+/m1/s1
    • InChI Key: RKDOFSJTBIDAHX-CYHLAULCSA-N
    • SMILES: O(C(C)=O)[C@@H]1CCN2CC=C(COC([C@@]([C@@H](C)O)(C(C)C)O)=O)[C@@H]21

Computed Properties

  • Exact Mass: 341.184
  • Monoisotopic Mass: 341.184
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 8
  • Complexity: 531
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 96.3A^2
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 0.1

Experimental Properties

  • Color/Form: Powder
  • Density: 1.24
  • Boiling Point: 466°C at 760 mmHg
  • Flash Point: 235.6°C
  • Refractive Index: 1.546

7-Acetylintermedine Security Information

  • Hazardous Material transportation number:1544
  • HazardClass:6.1(b)
  • PackingGroup:III

7-Acetylintermedine Pricemore >>

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