Rubijervine

CAS Registry Number®

79-58-3

CAS Name

Rubijervine

Molecular Formula

C27H43NO2

Molecular Mass

413.64

Cite this Page

Rubijervine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=79-58-3 (retrieved 2024-11-22) (CAS RN: 79-58-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    242 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C27H43NO2/c1-15-5-8-22-16(2)25-23(28(22)14-15)12-21-19-7-6-17-11-18(29)9-10-26(17,3)20(19)13-24(30)27(21,25)4/h6,15-16,18-25,29-30H,5,7-14H2,1-4H3/t15-,16+,18-,19+,20-,21-,22+,23-,24-,25-,26-,27+/m0/s1

InChIKey

InChIKey=AANKDJLVHZQCFG-KVHNBARJSA-N

SMILES

C[C@@]12[C@@]3([C@@](N4[C@@]([C@H]3C)(CC[C@H](C)C4)[H])(C[C@]1([C@]5([C@](C[C@@H]2O)([C@]6(C)C(=CC5)C[C@@H](O)CC6)[H])[H])[H])[H])[H]

Canonical SMILES

OC1CC2=CCC3C(CC(O)C4(C)C3CC5N6CC(C)CCC6C(C)C54)C2(C)CC1

Other Names for this Substance

  • Solanid-5-ene-3,12-diol, (3β,12α)-
  • Solanid-5-ene-3β,12α-diol
  • Rubijervine
  • 1H-Naphth[2′,1′:4,5]indeno[1,2-b]indolizine, solanid-5-ene-3,12-diol deriv.
  • (3β,12α)-Solanid-5-ene-3,12-diol

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration