| SpectraBase Spectrum ID |
WXQ9Vr4m1R |
| Name |
A'-Neogammaceran-29-ol |
| CAS Registry Number |
59123-03-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H52O |
| InChI |
InChI=1S/C30H52O/c1-20(19-31)21-11-16-27(4)22(21)12-17-29(6)24(27)9-10-25-28(5)15-8-14-26(2,3)23(28)13-18-30(25,29)7/h20-25,31H,8-19H2,1-7H3/t20?,21-,22+,23+,24-,25-,27+,28+,29-,30-/m1/s1 |
| InChIKey |
JUVRJUWZCPMWHK-RCOVIKTCSA-N |
| Molecular Weight |
428.745 g/mol |
| SMILES |
OCC([C@@]1([C@@]2(CC[C@]3([C@]4([C@@]([C@]5(CCCC([C@@]5(CC4)[H])(C)C)C)(CC[C@@]3([C@]2(CC1)C)[H])[H])C)C)[H])[H])C |
| SPLASH |
splash10-0a4l-0690000000-1be045c676fbf7e2dbbb |
| Source of Spectrum |
E1-40-1684-0 |
| Synonyms |
30-Hydroxyhopane
(2S)-2-[(3S,3aS,5aR,5bR,7aS,11aS,11bR,13aR,13bS)-5a,5b,8,8,11a,13b-hexamethylicosahydro-1H-cyclopenta[a]chrysen-3-yl]-1-propanol
1H-Cyclopenta[a]chrysene, A'-neogammaceran-29-ol deriv.
29-Hydroxyhopane
Hopan-29-ol |
| Wiley ID |
1519447 |
