CAS Registry Number®
23496-41-5
CAS Name
Peimine
Molecular Formula
C27H45NO3
Molecular Mass
431.65
Compound Properties
-
Melting Point (1)
223 °C
Source(s)
- (1) Chen, K. K.; Zhongguo Shenglixue Zazhi, (1932), 6, 265-70, CAplus
Other Names and Identifiers
InChI
InChI=1S/C27H45NO3/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/h15-25,29-31H,4-14H2,1-3H3/t15-,16-,17+,18+,19-,20-,21-,22-,23+,24-,25-,26+,27-/m0/s1
InChIKey
InChIKey=IUKLSMSEHKDIIP-BZMYINFQSA-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])(C[C@H](O)[C@]1(C[C@@H](O)CC2)[H])[H])[H]
Canonical SMILES
OC1CCC2(C)C(C1)C(O)CC3C4CCC5C(CN6CC(C)CCC6C5(O)C)C4CC32
Other Names for this Substance
- Cevane-3,6,20-triol, (3β,5α,6α)-
- 5α-Cevane-3β,6α,20-triol
- Verticine
- (3β,5α,6α)-Cevane-3,6,20-triol
- Dihydroisoimperialine
- Peimine
Deleted or Replaced CAS Registry Numbers
1360-30-1
