TEI 9647

CAS Registry Number®

173388-20-0
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CAS Name

TEI 9647

Molecular Formula

C27H38O4

Molecular Mass

426.59

Cite this Page

TEI 9647.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=173388-20-0 (retrieved 2024-05-20) (CAS RN: 173388-20-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H38O4/c1-16(12-22-13-17(2)26(30)31-22)23-9-10-24-19(6-5-11-27(23,24)4)7-8-20-14-21(28)15-25(29)18(20)3/h7-8,16,21-25,28-29H,2-3,5-6,9-15H2,1,4H3/b19-7+,20-8-/t16-,21-,22+,23-,24+,25+,27-/m1/s1

InChIKey

InChIKey=SAODSJHDCZTVAT-CZADFQNYSA-N

SMILES

C[C@@]12[C@](/C(=C/C=C/3\C(=C)[C@@H](O)C[C@H](O)C3)/CCC1)(CC[C@@]2([C@@H](C[C@H]4CC(=C)C(=O)O4)C)[H])[H]

Canonical SMILES

O=C1OC(CC1=C)CC(C)C2CCC3C(=CC=C4C(=C)C(O)CC(O)C4)CCCC32C

Other Names for this Substance

  • 2(3H)-Furanone, 5-[(2R)-2-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3S,5R)-3,5-dihydroxy-2-methylenecyclohexylidene]ethylidene]octahydro-7a-methyl-1H-inden-1-yl]propyl]dihydro-3-methylene-, (5S)-
  • 9,10-Secocholesta-5,7,10(19),25(27)-tetraen-26-oic acid, 1,3,23-trihydroxy-, γ-lactone, (1α,3β,5Z,7E,23S)-
  • (5S)-5-[(2R)-2-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3S,5R)-3,5-Dihydroxy-2-methylenecyclohexylidene]ethylidene]octahydro-7a-methyl-1H-inden-1-yl]propyl]dihydro-3-methylene-2(3H)-furanone
  • TEI 9647

Deleted or Replaced CAS Registry Numbers

1246849-95-5

CAS INSIGHTSTM
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