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CAS 43000-65-3

:

(4aS,4bR,6aS,8S,10aS,10bS,12aS)-Octadecahydro-10a,12a-dimethyl-2-oxonaphtho[2,1-f]quinolin-8-yl 4-[bis(2-chloroethyl)amino]benzeneacetate

Description:
The chemical substance with the name "(4aS,4bR,6aS,8S,10aS,10bS,12aS)-Octadecahydro-10a,12a-dimethyl-2-oxonaphtho[2,1-f]quinolin-8-yl 4-[bis(2-chloroethyl)amino]benzeneacetate" and CAS number "43000-65-3" is a complex organic compound characterized by its intricate molecular structure, which includes multiple stereocenters and functional groups. This compound features a naphthoquinoline framework, indicating potential biological activity, particularly in medicinal chemistry. The presence of the bis(2-chloroethyl)amino group suggests it may exhibit properties similar to alkylating agents, which are often used in cancer therapy. The acetate moiety may enhance solubility and bioavailability. Its stereochemistry, denoted by the specific configuration at various carbon centers, is crucial for its biological interactions and pharmacological effects. Overall, this compound's unique structural features may contribute to its potential therapeutic applications, although specific biological activity and safety profiles would require further investigation through experimental studies.
Formula:C31H44Cl2N2O3
InChI:InChI=1S/C31H44Cl2N2O3/c1-30-13-11-24(38-29(37)19-21-3-6-23(7-4-21)35(17-15-32)18-16-33)20-22(30)5-8-25-26(30)12-14-31(2)27(25)9-10-28(36)34-31/h3-4,6-7,22,24-27H,5,8-20H2,1-2H3,(H,34,36)/t22-,24-,25+,26-,27-,30-,31-/m0/s1
InChI key:InChIKey=JMZJBCNHUJOLER-AYQCGTONSA-N
SMILES:C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)NC(=O)CC4)[H])(CC[C@]1(C[C@@H](OC(CC5=CC=C(N(CCCl)CCCl)C=C5)=O)CC2)[H])[H])[H]
Synonyms:
  • (4aS,4bR,6aS,8S,10aS,10bS,12aS)-Octadecahydro-10a,12a-dimethyl-2-oxonaphtho[2,1-f]quinolin-8-yl 4-[bis(2-chloroethyl)amino]benzeneacetate
  • DAL 8
  • NSC 620482
  • 17a-Aza-D-homoandrostan-17-one, 3-[[[4-[bis(2-chloroethyl)amino]phenyl]acetyl]oxy]-, (3β,5α)-
  • Benzeneacetic acid, 4-[bis(2-chloroethyl)amino]-, (4aS,4bR,6aS,8S,10aS,10bS,12aS)-octadecahydro-10a,12a-dimethyl-2-oxonaphtho[2,1-f]quinolin-8-yl ester
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Found 1 products.
  • Lactandrate
    Targetmol
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    Lactandrate

    CAS:
    <p>Lactandrate is a homo-aza-steroidal ester of p-bis(2-chloroethyl) amino phenyl acetic acid.</p>
    Formula:C31H44Cl2N2O3
    Color and Shape:Solid
    Molecular weight:563.6

    Ref: TM-T32526