| SpectraBase Spectrum ID |
GXIlSqTH2bN |
| Name |
Kaur-16-ene-15-carboxylic acid, (5.alpha.,9.alpha.,10.beta.,15.alpha.)- |
| Alternate Name(s) |
(13alpha,15alpha)-kaur-16-ene-15-carboxylic acid
(15.alpha.)-Phylloclad-16-ene-15-carboxylic acid
1H-2,10a-ethanophenanthrene, kaur-16-ene-15-carboxylic acid deriv. |
| CAS Registry Number |
56361-52-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H32O2 |
| InChI |
InChI=1S/C21H32O2/c1-13-14-6-7-16-20(4)10-5-9-19(2,3)15(20)8-11-21(16,12-14)17(13)18(22)23/h14-17H,1,5-12H2,2-4H3,(H,22,23)/t14-,15+,16-,17+,20+,21+/m1/s1 |
| InChIKey |
ZUJGHWRPTDHVOZ-GDXXKUFXSA-N |
| Molecular Weight |
316.485 g/mol |
| SMILES |
OC([C@]1([C@]23[C@@]([C@]4(CCCC([C@@]4(CC3)[H])(C)C)C)(CC[C@](C2)(C1=C)[H])[H])[H])=O |
| SPLASH |
splash10-014i-0009000000-4bd706ccaa0db93d4412 |
| Source of Spectrum |
B-33-2069-0 |
| Wiley ID |
1317274 |
