Olean-12-en-28-al, 3β,16α,22α-trihydroxy-, 16-acetate
CAS Registry Number®
26339-85-5
CAS Name
Olean-12-en-28-al, 3β,16α,22α-trihydroxy-, 16-acetateMolecular Formula
C32H50O5Molecular Mass
514.74Cite this Page
Olean-12-en-28-al, 3β,16α,22α-trihydroxy-, 16-acetate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=26339-85-5 (retrieved ) (CAS RN: 26339-85-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C32H50O5/c1-19(34)37-26-17-31(8)20(21-15-27(2,3)16-25(36)32(21,26)18-33)9-10-23-29(6)13-12-24(35)28(4,5)22(29)11-14-30(23,31)7/h9,18,21-26,35-36H,10-17H2,1-8H3/t21-,22-,23+,24-,25-,26+,29-,30+,31+,32+/m0/s1
InChIKey
InChIKey=RVLOLIBRTUMCPC-UCHQZINUSA-N
SMILES
C(=O)[C@]12[C@](C=3[C@@](C)(C[C@H]1OC(C)=O)[C@@]4(C)[C@](CC3)([C@]5(C)[C@@](CC4)(C(C)(C)[C@@H](O)CC5)[H])[H])(CC(C)(C)C[C@@H]2O)[H]
Canonical SMILES
O=CC12C(O)CC(C)(C)CC2C3=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CC1OC(=O)C
Other Names for this Substance
- Olean-12-en-28-al, 3β,16α,22α-trihydroxy-, 16-acetate