TAS 108

CAS Registry Number®

229634-98-4
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CAS Name

TAS 108

Molecular Formula

C33H47NO3.C6H8O7

Cite this Page

TAS 108.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=229634-98-4 (retrieved 2024-04-25) (CAS RN: 229634-98-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C33H47NO3.C6H8O7/c1-6-34(7-2)21-23-8-13-30(31(19-23)36-5)37-17-15-25-9-12-29-32-22(3)18-24-20-26(35)10-11-27(24)28(32)14-16-33(25,29)4;7-3(8)1-6(13,5(11)12)2-4(9)10/h8,10-11,13,19-20,22,25,28-29,32,35H,6-7,9,12,14-18,21H2,1-5H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t22-,25-,28-,29+,32-,33-;/m1./s1

InChIKey

InChIKey=VOHOCSJONOJOSD-SCIDSJFVSA-N

SMILES

C[C@H]1[C@]2([C@]3([C@@](C)([C@@H](CCOC4=C(OC)C=C(CN(CC)CC)C=C4)CC3)CC[C@@]2(C=5C(C1)=CC(O)=CC5)[H])[H])[H].C(CC(O)=O)(CC(O)=O)(C(O)=O)O

Canonical SMILES

O=C(O)CC(O)(C(=O)O)CC(=O)O.OC1=CC=C2C(=C1)CC(C)C3C2CCC4(C)C(CCOC5=CC=C(C=C5OC)CN(CC)CC)CCC34

Other Names for this Substance

  • 19-Norpregna-1,3,5(10)-trien-3-ol, 21-[4-[(diethylamino)methyl]-2-methoxyphenoxy]-7-methyl-, (7α)-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1) (salt)
  • SR 16234
  • TAS 108
  • HLX 801

Deleted or Replaced CAS Registry Numbers

354808-47-2

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