SpectraBase Spectrum ID |
9XrjmU7zGJ7 |
Name |
(22E)-27-nor-24-Methyl-5.alpha.-cholesta-7,22-diene-3.beta.,6.alpha.-diol |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H44O2 |
InChI |
InChI=1S/C27H44O2/c1-6-17(2)7-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h7-8,16-19,21-25,28-29H,6,9-15H2,1-5H3/b8-7+/t17?,18-,19+,21-,22+,23+,24-,25+,26-,27-/m1/s1 |
InChIKey |
AGDRCAOKIMESGN-OSVXTPMVSA-N |
Molecular Weight |
400.647 g/mol |
SMILES |
O[C@@]1([C@]2(C[C@](CC[C@@]2([C@@]2(C(=C1)[C@]1([C@](CC2)([C@](CC1)([C@@](\C=C\C(CC)C)(C)[H])[H])C)[H])[H])C)(O)[H])[H])[H] |
SPLASH |
splash10-0udi-0094500000-4155f05c84f26dd13f14 |
Source of Spectrum |
X2-52-959-4 |
Synonyms |
(1R,2R,5S,7S,8S,11R,14R,15R)-2,15-dimethyl-14-[(2R,3E)-5-methylhept-3-en-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-9-ene-5,8-diol |
Wiley ID |
1603259 |