Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: (20beta)-3beta-Acetoxy-11-oxoolean-12-en-29-oic acid, compound with 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-o-anisamide (1:1)
RN: 60544-81-2
InChIKey: ZETNVBPRKJHKHB-PGWZUXJMSA-N

Molecular Formula

  • C32-H48-O5.C14-H22-Cl-N3-O2

Molecular Weight

  • 812.526
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • EINECS 262-287-0

Systematic Name

  • (20beta)-3beta-Acetoxy-11-oxoolean-12-en-29-oic acid, compound with 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-o-anisamide (1:1)

Registry Numbers

CAS Registry Number

  • 60544-81-2

System Generated Number

  • 0060544812

Molecular Formulas

Molecular Formula

  • C32-H48-O5.C14-H22-Cl-N3-O2

Molecular Formula Fragments

  • C14-H22-Cl-N3-O2
  • C32-H48-O5
  • COMPONENT

Structure Descriptors

InChI

1S/C32H48O5.C14H22ClN3O2/c1-19(33)37-24-10-11-30(6)23(27(24,2)3)9-12-32(8)25(30)22(34)17-20-21-18-29(5,26(35)36)14-13-28(21,4)15-16-31(20,32)7;1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3/h17,21,23-25H,9-16,18H2,1-8H3,(H,35,36);8-9H,4-7,16H2,1-3H3,(H,17,19)/t21-,23?,24+,25-,28-,29-,30+,31-,32-;/m1./s1

InChIKey

ZETNVBPRKJHKHB-PGWZUXJMSA-N

Smiles

CCN(CC)CCNC(=O)c1cc(c(cc1OC)N)Cl.CC(=O)O[C@H]1CC[C@@]2([C@H]3C(=O)C=C4[C@H]5C[C@](CC[C@@]5(CC[C@]4([C@@]3(CCC2C1(C)C)C)C)C)(C)C(=O)O)C