1H-Cyclohepta[1,2-a:5,4-a′]dinaphthalene-3,11-diol, 2,3,4,4a,5,6,6a,7,9,9a,10,11,12,13,13a,13b,14,15,15a,15b-eicosahydro-4,4,6a,10,10,13a,15b-heptamethyl-, 3-acetate, (3S,4aR,6aS,9aR,11R,13aR,13bS,15aS,15bR)-

CAS Registry Number®

1260-05-5

CAS Name

1H-Cyclohepta[1,2-a:5,4-a′]dinaphthalene-3,11-diol, 2,3,4,4a,5,6,6a,7,9,9a,10,11,12,13,13a,13b,14,15,15a,15b-eicosahydro-4,4,6a,10,10,13a,15b-heptamethyl-, 3-acetate, (3S,4aR,6aS,9aR,11R,13aR,13bS,15aS,15bR)-

Molecular Formula

C32H52O3

Molecular Mass

484.75

Cite this Page

1H-Cyclohepta[1,2-a:5,4-a′]dinaphthalene-3,11-diol, 2,3,4,4a,5,6,6a,7,9,9a,10,11,12,13,13a,13b,14,15,15a,15b-eicosahydro-4,4,6a,10,10,13a,15b-heptamethyl-, 3-acetate, (3S,4aR,6aS,9aR,11R,13aR,13bS,15aS,15bR)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1260-05-5 (retrieved 2024-11-25) (CAS RN: 1260-05-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    317-319 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C32H52O3/c1-20(33)35-27-15-18-32(8)24(29(27,4)5)13-16-30(6)19-21-9-11-23-28(2,3)26(34)14-17-31(23,7)22(21)10-12-25(30)32/h9,22-27,34H,10-19H2,1-8H3/t22-,23-,24-,25-,26+,27-,30-,31+,32-/m0/s1

InChIKey

InChIKey=JTMRPEBSVBAWGS-UFEYJMCTSA-N

SMILES

C[C@@]12[C@@]3([C@](C)(CC=4[C@](CC3)([C@]5(C)[C@@](CC4)(C(C)(C)[C@H](O)CC5)[H])[H])CC[C@]1(C(C)(C)[C@@H](OC(C)=O)CC2)[H])[H]

Canonical SMILES

O=C(OC1CCC2(C)C(CCC3(C)CC4=CCC5C(C)(C)C(O)CCC5(C)C4CCC32)C1(C)C)C

Other Names for this Substance

  • 1H-Cyclohepta[1,2-a:5,4-a′]dinaphthalene-3,11-diol, 2,3,4,4a,5,6,6a,7,9,9a,10,11,12,13,13a,13b,14,15,15a,15b-eicosahydro-4,4,6a,10,10,13a,15b-heptamethyl-, 3-acetate, (3S,4aR,6aS,9aR,11R,13aR,13bS,15aS,15bR)-
  • C(14a)-Homo-27-norgammacer-14-ene-3,21-diol, 3-acetate, (3β,21β)-
  • 21-Episerratenediol, 3-acetate
  • Phlegmanol C
  • 21-epi-Serratenediol 3-acetate

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