(3β,25R)-6-Methylspirost-5-en-3-yl acetate

CAS Registry Number®

6877-73-2
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CAS Name

(3β,25R)-6-Methylspirost-5-en-3-yl acetate

Molecular Formula

C30H46O4

Molecular Mass

470.68

Cite this Page

(3β,25R)-6-Methylspirost-5-en-3-yl acetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6877-73-2 (retrieved 2024-07-01) (CAS RN: 6877-73-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    217.5-219.0 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C30H46O4/c1-17-7-12-30(32-16-17)19(3)27-26(34-30)15-25-22-13-18(2)24-14-21(33-20(4)31)8-10-28(24,5)23(22)9-11-29(25,27)6/h17,19,21-23,25-27H,7-16H2,1-6H3/t17-,19+,21+,22-,23+,25+,26+,27+,28-,29+,30-/m1/s1

InChIKey

InChIKey=OGEFDNIZNJRWMH-AUBPAKAUSA-N

SMILES

C[C@@]12[C@@]3([C@@](O[C@@]4([C@H]3C)CC[C@@H](C)CO4)(C[C@]1([C@]5([C@](CC2)([C@]6(C)C(=C(C)C5)C[C@@H](OC(C)=O)CC6)[H])[H])[H])[H])[H]

Canonical SMILES

O=C(OC1CC2=C(C)CC3C(CCC4(C)C3CC5OC6(OCC(C)CC6)C(C)C54)C2(C)CC1)C

Other Names for this Substance

  • Spirost-5-en-3-ol, 6-methyl-, 3-acetate, (3β,25R)-
  • Spirost-5-en-3-ol, 6-methyl-, acetate, (3β,25R)-
  • 25D-Spirost-5-en-3β-ol, 6-methyl-, acetate
  • Spiro[8H-naphth[2′,1′:4,5]indeno[2,1-b]furan-8,2′-[2H]pyran], spirost-5-en-3-ol deriv.
  • (3β,25R)-6-Methylspirost-5-en-3-yl acetate

Deleted or Replaced CAS Registry Numbers

1080632-78-5