(2β,8α,9β,10α,13α,14β,20β,22β)-2,22-Dihydroxy-9,13-dimethyl-24,25,26,30-tetranorolean-4-ene-3,21-dione

CAS Registry Number®

201534-10-3
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CAS Name

(2β,8α,9β,10α,13α,14β,20β,22β)-2,22-Dihydroxy-9,13-dimethyl-24,25,26,30-tetranorolean-4-ene-3,21-dione

Molecular Formula

C28H42O4

Molecular Mass

442.63

Cite this Page

(2β,8α,9β,10α,13α,14β,20β,22β)-2,22-Dihydroxy-9,13-dimethyl-24,25,26,30-tetranorolean-4-ene-3,21-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=201534-10-3 (retrieved 2024-07-26) (CAS RN: 201534-10-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C28H42O4/c1-15-13-21-26(4,24(32)22(15)30)10-12-27(5)20-8-7-17-16(2)23(31)19(29)14-18(17)25(20,3)9-11-28(21,27)6/h15,18-21,24,29,32H,7-14H2,1-6H3/t15-,18-,19+,20+,21-,24-,25+,26-,27-,28+/m1/s1

InChIKey

InChIKey=UUGCGHAFZPEHIC-OIOGIDCRSA-N

SMILES

C[C@@]12[C@](C)([C@]3([C@@](C)(CC1)[C@H](O)C(=O)[C@H](C)C3)[H])CC[C@]4(C)[C@@]2(CCC=5[C@]4(C[C@H](O)C(=O)C5C)[H])[H]

Canonical SMILES

O=C1C(=C2CCC3C(C)(CCC4(C)C5CC(C(=O)C(O)C5(C)CCC34C)C)C2CC1O)C

Other Names for this Substance

  • 24,25,26,30-Tetranorolean-4-ene-3,21-dione, 2,22-dihydroxy-9,13-dimethyl-, (2β,8α,9β,10α,13α,14β,20β,22β)-
  • (2β,8α,9β,10α,13α,14β,20β,22β)-2,22-Dihydroxy-9,13-dimethyl-24,25,26,30-tetranorolean-4-ene-3,21-dione
  • Triptocalline A
  • Triptocallin A