sipeimine[西贝明]

61825-98-7

CAS Name

Imperialine

Molecular Formula

C₂₇H₄₃NO₃

Molecular Mass

429.64

Compound Properties

• Melting Point (1)

  267 °C

Source(s)

• (1) Boit, Hans G.; Chemische Berichte, (1954), 87, 472-5, CAplus

Other Names and Identifiers

InChI

InChI=1S/C27H43NO3/c1-15-4-7-25-27(3,31)21-6-5-17-18(20(21)14-28(25)13-15)11-22-19(17)12-24(30)23-10-16(29)8-9-26(22,23)2/h15-23,25,29,31H,4-14H2,1-3H3/t15-,16-,17+,18+,19-,20-,21+,22-,23+,25-,26+,27-/m0/s1

InChIKey

InChIKey=IQDIERHFZVCNRZ-LRCDAWNTSA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@@](C3)([C@]5([C@@](CC4)([C@](C)(O)[C@]6(N(C5)C[C@@H](C)CC6)[H])[H])[H])[H])[H])(CC(=O)[C@]1(C[C@@H](O)CC2)[H])[H])[H]

Canonical SMILES

O=C1CC2C3CCC4C(CN5CC(C)CCC5C4(O)C)C3CC2C6(C)CCC(O)CC16

Other Names for this Substance