(3R,6S,6aS,7R,7aS,10S,12aS,13R,13aR,14S,15R)-1-Ethyltetradecahydro-12a,14-dihydroxy-6-methoxy-3-methyl-8H-13,3,6a-ethanylylidene-7,10-methanooxepino[3,4-i]-1-benzazocin-8-one

CAS Registry Number®

3328-84-5

CAS Name

(3R,6S,6aS,7R,7aS,10S,12aS,13R,13aR,14S,15R)-1-Ethyltetradecahydro-12a,14-dihydroxy-6-methoxy-3-methyl-8H-13,3,6a-ethanylylidene-7,10-methanooxepino[3,4-i]-1-benzazocin-8-one

Molecular Formula

C22H33NO5

Molecular Mass

391.50

Cite this Page

(3R,6S,6aS,7R,7aS,10S,12aS,13R,13aR,14S,15R)-1-Ethyltetradecahydro-12a,14-dihydroxy-6-methoxy-3-methyl-8H-13,3,6a-ethanylylidene-7,10-methanooxepino[3,4-i]-1-benzazocin-8-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3328-84-5 (retrieved 2024-11-13) (CAS RN: 3328-84-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    262-267 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C22H33NO5/c1-4-23-10-20(2)7-6-13(27-3)22-12-9-11-5-8-21(26,14(12)19(25)28-11)15(18(22)23)16(24)17(20)22/h11-18,24,26H,4-10H2,1-3H3/t11?,12-,13+,14-,15+,16-,17-,18?,20+,21-,22+/m1/s1

InChIKey

InChIKey=YPSAOPXJHSESSR-IZDUYTNUSA-N

SMILES

O(C)[C@@H]1[C@]23C4([C@]([C@@H](O)[C@@]2([C@](C)(CN4CC)CC1)[H])([C@]5(O)[C@@]6([C@]3(CC(OC6=O)(CC5)[H])[H])[H])[H])[H]

Canonical SMILES

O=C1OC2CCC3(O)C1C(C2)C45C(OC)CCC6(C)CN(CC)C5C3C(O)C64

Other Names for this Substance

  • 8H-13,3,6a-Ethanylylidene-7,10-methanooxepino[3,4-i]-1-benzazocin-8-one, 1-ethyltetradecahydro-12a,14-dihydroxy-6-methoxy-3-methyl-, (3R,6S,6aS,7R,7aS,10S,12aS,13R,13aR,14S,15R)-
  • Heteratisine
  • Heteratisan-14-one, 20-ethyl-6,8-dihydroxy-1-methoxy-4-methyl-, (1α,6β)-
  • (3R,6S,6aS,7R,7aS,10S,12aS,13R,13aR,14S,15R)-1-Ethyltetradecahydro-12a,14-dihydroxy-6-methoxy-3-methyl-8H-13,3,6a-ethanylylidene-7,10-methanooxepino[3,4-i]-1-benzazocin-8-one
  • 8H-13,3,6a-Ethanylylidene-7,10-methanooxepino[3,4-i]-1-benzazocin-8-one, 1-ethyltetradecahydro-12a,14-dihydroxy-6-methoxy-3-methyl-, [3R-(3α,6β,6aα,7β,7aα,10β,12aα,13α,13aβ,14S*,15R*)]-

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Deleted or Replaced CAS Registry Numbers

1071658-20-2

CAS INSIGHTSTM
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