(2S,5R,5aS,5bS,7aS,7bR,10aS,11aS,11bS,13aR)-Octadecahydro-5a,7a-dimethyl-2,5-epoxyfuro[3′′,2′′:3′,4′]cyclopenta[1′,2′:5,6]naphth[1,2-d]azepin-9(1H)-one

CAS Registry Number®

6384-73-2

CAS Name

(2S,5R,5aS,5bS,7aS,7bR,10aS,11aS,11bS,13aR)-Octadecahydro-5a,7a-dimethyl-2,5-epoxyfuro[3′′,2′′:3′,4′]cyclopenta[1′,2′:5,6]naphth[1,2-d]azepin-9(1H)-one

Molecular Formula

C21H31NO3

Molecular Mass

345.48

Cite this Page

(2S,5R,5aS,5bS,7aS,7bR,10aS,11aS,11bS,13aR)-Octadecahydro-5a,7a-dimethyl-2,5-epoxyfuro[3′′,2′′:3′,4′]cyclopenta[1′,2′:5,6]naphth[1,2-d]azepin-9(1H)-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6384-73-2 (retrieved 2024-12-26) (CAS RN: 6384-73-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    287-288 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H31NO3/c1-20-6-5-13-12(14(20)8-16-15(20)9-19(23)24-16)4-3-11-7-18-22-10-17(25-18)21(11,13)2/h11-18,22H,3-10H2,1-2H3/t11-,12-,13+,14+,15+,16+,17+,18+,20+,21+/m1/s1

InChIKey

InChIKey=GUSZSGSYIVZEDM-MZDLDJOOSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@]([C@]4(C)[C@](CC3)(C[C@@]5(O[C@]4(CN5)[H])[H])[H])(CC1)[H])[H])(C[C@]6([C@@]2(CC(=O)O6)[H])[H])[H]

Canonical SMILES

O=C1OC2CC3C4CCC5CC6OC(CN6)C5(C)C4CCC3(C)C2C1

Other Names for this Substance

  • 2,5-Epoxyfuro[3′′,2′′:3′,4′]cyclopenta[1′,2′:5,6]naphth[1,2-d]azepin-9(1H)-one, octadecahydro-5a,7a-dimethyl-, (2S,5R,5aS,5bS,7aS,7bR,10aS,11aS,11bS,13aR)-
  • Samandaridine
  • 3-Aza-A-homopregnan-21-oic acid, 1,4-epoxy-16-hydroxy-, γ-lactone, (1α,4α,5β,16β)-
  • (2S,5R,5aS,5bS,7aS,7bR,10aS,11aS,11bS,13aR)-Octadecahydro-5a,7a-dimethyl-2,5-epoxyfuro[3′′,2′′:3′,4′]cyclopenta[1′,2′:5,6]naphth[1,2-d]azepin-9(1H)-one
  • Samandaridin

View All

Deleted or Replaced CAS Registry Numbers

31561-29-2, 1071658-61-1

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