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-acetate

Molecular Formula

C32H50O5

Molecular Mass

514.74

Cite 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 2024-11-23) (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

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