| SpectraBase Spectrum ID |
KTQyaTayKsA |
| Name |
3,4-Secocholest-5-en-4-al, 3,3-bis(1-methylethoxy)-, oxime |
| Alternate Name(s) |
(3R,3aR,5aS,6R,9aS,9bS)-6-(3,3-diisopropoxypropyl)-3-[(1R)-1,5-dimethylhexyl]-3a,6-dimethyl-2,3,3a,4,5,5a,6,9,9a,9b-decahydro-1H-cyclopenta[a]naphthalene-7-carbaldehyde oxime
3,3-Bisisopropoxy-3,4-secocholest-5-en-4-one-oxime |
| CAS Registry Number |
81920-84-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C33H59NO3 |
| InChI |
InChI=1S/C33H59NO3/c1-22(2)11-10-12-25(7)28-15-16-29-27-14-13-26(21-34-35)32(8,30(27)17-19-33(28,29)9)20-18-31(36-23(3)4)37-24(5)6/h13,21-25,27-31,35H,10-12,14-20H2,1-9H3/b34-21+/t25-,27+,28-,29+,30+,32+,33-/m1/s1 |
| InChIKey |
GAIYJSJFHPQYJZ-XXIRYAOVSA-N |
| Molecular Weight |
517.839 g/mol |
| SMILES |
O\N=C\C=1[C@@]([C@]2(CC[C@]3([C@]([C@@]2(CC1)[H])(CC[C@@]3([C@@](CCCC(C)C)(C)[H])[H])[H])C)[H])(CCC(OC(C)C)OC(C)C)C |
| SPLASH |
splash10-001s-9201000000-b059bfceb1462776512d |
| Source of Spectrum |
KC-1982-115-0 |
| Wiley ID |
1401582 |
