Veratrosine

CAS Registry Number®

475-00-3
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CAS Name

Veratrosine

Molecular Formula

C33H49NO7

Molecular Mass

571.74

Cite this Page

Veratrosine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=475-00-3 (retrieved 2024-05-18) (CAS RN: 475-00-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    235-243 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C33H49NO7/c1-16-11-26(36)28(34-14-16)18(3)21-7-8-22-23-6-5-19-12-20(9-10-33(19,4)25(23)13-24(22)17(21)2)40-32-31(39)30(38)29(37)27(15-35)41-32/h5,7-8,16,18,20,23,25-32,34-39H,6,9-15H2,1-4H3/t16-,18-,20-,23-,25-,26+,27+,28-,29+,30-,31+,32+,33-/m0/s1

InChIKey

InChIKey=WXQHVBNTINGJJR-NIFRNHPISA-N

SMILES

C[C@@]12[C@@]3([C@](C=4C(C3)=C(C)C([C@H](C)[C@]5([C@H](O)C[C@H](C)CN5)[H])=CC4)(CC=C1C[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC2)[H])[H]

Canonical SMILES

OCC1OC(OC2CC3=CCC4C5=CC=C(C(=C5CC4C3(C)CC2)C)C(C)C6NCC(C)CC6O)C(O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranoside, (3β,23β)-14,15,16,17-tetradehydro-23-hydroxyveratraman-3-yl
  • Veratrosine
  • 1H-Benzo[a]fluorene, β-D-glucopyranoside deriv.
  • Veratraman, β-D-glucopyranoside deriv.
  • (3β,23β)-14,15,16,17-Tetradehydro-23-hydroxyveratraman-3-yl β-D-glucopyranoside

View All

Deleted or Replaced CAS Registry Numbers

27938-51-8

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