| SpectraBase Spectrum ID |
KV9ZAMfjsRn |
| Name |
3-.alpha.Hydroxy-9B-acetoxyeudesm-4,11(13)-dien-12-oic acid methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.178023932 u |
| Formula |
C18H26O5 |
| InChI |
InChI=1S/C18H26O5/c1-10(17(21)22-5)13-8-14-11(2)15(20)6-7-18(14,4)16(9-13)23-12(3)19/h13,15-16,20H,1,6-9H2,2-5H3/t13-,15+,16-,18-/m0/s1 |
| InChIKey |
NIKGNSGBQCVYCJ-DNMXQMFDSA-N |
| Molecular Weight |
322.401 g/mol |
| SMILES |
C=12[C@@]([C@@](OC(=O)C)(C[C@](C2)(C(C(=O)OC)=C)[H])[H])(CC[C@](C1C)(O)[H])C |
