(16aS)-3,5,16a,17,18,19-Hexahydro-12,20,21,22,26-pentamethoxy-17-methyl-16H-1,24:6,9-dietheno-11,15-metheno-2H-pyrido[2′,3′:17,18][1,11]dioxacycloeicosino[2,3,4-ij]isoquinoline

CAS Registry Number®

5525-36-0
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CAS Name

(16aS)-3,5,16a,17,18,19-Hexahydro-12,20,21,22,26-pentamethoxy-17-methyl-16H-1,24:6,9-dietheno-11,15-metheno-2H-pyrido[2′,3′:17,18][1,11]dioxacycloeicosino[2,3,4-ij]isoquinoline

Molecular Formula

C38H40N2O7

Molecular Mass

636.73

Cite this Page

(16aS)-3,5,16a,17,18,19-Hexahydro-12,20,21,22,26-pentamethoxy-17-methyl-16H-1,24:6,9-dietheno-11,15-metheno-2H-pyrido[2′,3′:17,18][1,11]dioxacycloeicosino[2,3,4-ij]isoquinoline.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5525-36-0 (retrieved 2024-09-20) (CAS RN: 5525-36-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    140-142 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C38H40N2O7/c1-40-16-14-26-34-29(40)18-23-9-12-30(41-2)32(19-23)46-25-10-7-22(8-11-25)17-28-27-21-33(31(42-3)20-24(27)13-15-39-28)47-36(34)38(45-6)37(44-5)35(26)43-4/h7-12,19-21,29H,13-18H2,1-6H3/t29-/m0/s1

InChIKey

InChIKey=YWNUNVSMOKMJMG-LJAQVGFWSA-N

SMILES

O(C)C1=C2C3=C(C(OC)=C1OC)CCN(C)[C@]3(CC=4C=C(C(OC)=CC4)OC=5C=CC(CC=6C7=CC(O2)=C(OC)C=C7CCN6)=CC5)[H]

Canonical SMILES

N1=C2C=3C=C(OC=4C(OC)=C(OC)C(OC)=C5C4C(N(C)CC5)CC6=CC=C(OC)C(OC7=CC=C(C=C7)C2)=C6)C(OC)=CC3CC1

Other Names for this Substance

  • 16H-1,24:6,9-Dietheno-11,15-metheno-2H-pyrido[2′,3′:17,18][1,11]dioxacycloeicosino[2,3,4-ij]isoquinoline, 3,5,16a,17,18,19-hexahydro-12,20,21,22,26-pentamethoxy-17-methyl-, (16aS)-
  • Thalcimine
  • 16H-1,24:6,9-Dietheno-11,15-metheno-2H-pyrido[2′,3′:17,18][1,11]dioxacycloeicosino[2,3,4-ij]isoquinoline, 3,5,16a,17,18,19-hexahydro-12,20,21,22,26-pentamethoxy-17-methyl-, (S)-
  • (16aS)-3,5,16a,17,18,19-Hexahydro-12,20,21,22,26-pentamethoxy-17-methyl-16H-1,24:6,9-dietheno-11,15-metheno-2H-pyrido[2′,3′:17,18][1,11]dioxacycloeicosino[2,3,4-ij]isoquinoline
  • Thalsimine

Deleted or Replaced CAS Registry Numbers

1610-58-8