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Substance Name: N-(3-(Oleoyloxy)androst-5-en-17-yl(pentyloxycarbonyl))-N-N-bis(2-chloroethyl)amine
RN: 90343-98-9
InChIKey: ZYRFGAQSKXTMJV-DYXKCHOISA-N

Molecular Formula

  • C47-H79-Cl2-N-O4

Molecular Weight

  • 793.0501
 
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Names and Synonyms

Name of Substance

  • N-(3-(Oleoyloxy)androst-5-en-17-yl(pentyloxycarbonyl))-N-N-bis(2-chloroethyl)amine

Synonym

  • Oapoc-bcea

Systematic Name

  • Chol-5-ene-3,24-diol, 24-(bis(2-chloroethyl)carbamate) 3-(9-octadecenoate), (3beta(Z))-

Registry Numbers

CAS Registry Number

  • 90343-98-9

System Generated Number

  • 0090343989

Structure Descriptors

InChI

1S/C47H79Cl2NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-44(51)54-39-27-29-46(3)38(36-39)23-24-40-42-26-25-41(47(42,4)30-28-43(40)46)37(2)21-20-35-53-45(52)50(33-31-48)34-32-49/h12-13,23,37,39-43H,5-11,14-22,24-36H2,1-4H3/b13-12-/t37-,39+,40+,41-,42+,43+,46+,47-/m1/s1

InChIKey

ZYRFGAQSKXTMJV-DYXKCHOISA-N

Smiles

CCCCCCCC/C=C\CCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCOC(=O)N(CCCl)CCCl)C)C