1-Phenanthrenecarboxylic acid, 7-[2-[2-(dimethylamino)ethoxy]-2-oxoethylidene]tetradecahydro-1,4a,8-trimethyl-9-oxo-, methyl ester, hydrochloride, [1S-(1α,4aα,4bβ,7E,8β,8aα,10aβ)]-

CAS Registry Number®

25390-20-9
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CAS Name

1-Phenanthrenecarboxylic acid, 7-[2-[2-(dimethylamino)ethoxy]-2-oxoethylidene]tetradecahydro-1,4a,8-trimethyl-9-oxo-, methyl ester, hydrochloride, [1S-(1α,4aα,4bβ,7E,8β,8aα,10aβ)]-

Molecular Formula

C25H39NO5.ClH

Cite this Page

1-Phenanthrenecarboxylic acid, 7-[2-[2-(dimethylamino)ethoxy]-2-oxoethylidene]tetradecahydro-1,4a,8-trimethyl-9-oxo-, methyl ester, hydrochloride, [1S-(1α,4aα,4bβ,7E,8β,8aα,10aβ)]-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=25390-20-9 (retrieved 2024-05-16) (CAS RN: 25390-20-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    214-217 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C25H39NO5.ClH/c1-16-17(14-21(28)31-13-12-26(4)5)8-9-18-22(16)19(27)15-20-24(18,2)10-7-11-25(20,3)23(29)30-6;/h14,16,18,20,22H,7-13,15H2,1-6H3;1H/b17-14+;/t16-,18-,20+,22-,24+,25-;/m0./s1

InChIKey

InChIKey=OCRDACOTQOYSGP-PKBCFCONSA-N

SMILES

C[C@@]12[C@]([C@](C(OC)=O)(C)CCC1)(CC(=O)[C@@]3([C@@]2(CC/C(=C\C(OCCN(C)C)=O)/[C@@H]3C)[H])[H])[H].Cl

Canonical SMILES

Cl.O=C(OCCN(C)C)C=C1CCC2C(C(=O)CC3C(C(=O)OC)(C)CCCC23C)C1C

Other Names for this Substance

  • 1-Phenanthrenecarboxylic acid, 7-[2-[2-(dimethylamino)ethoxy]-2-oxoethylidene]tetradecahydro-1,4a,8-trimethyl-9-oxo-, methyl ester, hydrochloride, [1S-(1α,4aα,4bβ,7E,8β,8aα,10aβ)]-
  • Podocarpan-16-oic acid, 13-(carboxymethylene)-14-methyl-7-oxo-, 13-[2-(dimethylamino)ethyl] methyl ester, monohydrochloride
  • Cassamine hydrochloride

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