(1α,3β,7α,14R)-3-(Acetyloxy)-1,7,14-trihydroxykaur-16-en-15-one

CAS Registry Number®

39388-61-9

CAS Name

(1α,3β,7α,14R)-3-(Acetyloxy)-1,7,14-trihydroxykaur-16-en-15-one

Molecular Formula

C22H32O6

Molecular Mass

392.49

Cite this Page

(1α,3β,7α,14R)-3-(Acetyloxy)-1,7,14-trihydroxykaur-16-en-15-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=39388-61-9 (retrieved 2025-01-08) (CAS RN: 39388-61-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H32O6/c1-10-12-6-7-13-21(5)14(8-16(25)22(13,18(10)26)19(12)27)20(3,4)17(9-15(21)24)28-11(2)23/h12-17,19,24-25,27H,1,6-9H2,2-5H3/t12-,13-,14+,15-,16+,17-,19?,21-,22-/m0/s1

InChIKey

InChIKey=DHKJGTMHEVCMKJ-GPXMKFAWSA-N

SMILES

OC1[C@@]23[C@]([C@@]4(C)[C@](C[C@H]2O)(C(C)(C)[C@@H](OC(C)=O)C[C@@H]4O)[H])(CC[C@]1(C(=C)C3=O)[H])[H]

Canonical SMILES

O=C(OC1CC(O)C2(C)C3CCC4C(=C)C(=O)C3(C(O)CC2C1(C)C)C4O)C

Other Names for this Substance

  • Kaur-16-en-15-one, 3-(acetyloxy)-1,7,14-trihydroxy-, (1α,3β,7α,14R)-
  • (1α,3β,7α,14R)-3-(Acetyloxy)-1,7,14-trihydroxykaur-16-en-15-one
  • Isodomedin

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