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Diploptene

Diploptene structure

CAS No:
1615-91-4
Formula:
C30H50
Chemical Name:
Diploptene
Synonyms:
A′-Neogammacer-22(29)-ene;Diploptene;Hopene b;1H-Cyclopenta[a]chrysene,A′-neogammacer-22(29)-ene deriv.;22(29)-Hopene;A′-Neogammacer-22(30)-ene;Hopene;114784-90-6
Categories:
Analytical Chemistry > Standard

Description

ChEBI: A triterpene consisting of hopane having a C2C double bond at the 22(29)-position.

Hop-22(29)-ene is a triterpene consisting of hopane having a C=C double bond at the 22(29)-position. It derives from a hydride of a hopane.

Diploptene Basic Attributes

Molecular Weight：

410.72

Exact Mass：

410.72

EC Number：

208-759-1

Characteristics

PSA：

XLogP3：

13.02

Density：

0.934±0.06 g/cm3(Predicted)

Melting Point：

151 °C @ Solvent: Acetone, Methanol

Boiling Point：

458.7±12.0 °C(Predicted)

Flash Point：

-12℃

Refractive Index：

1.504

Storage Conditions：

−20°C

Safety Information

Transport codes：

UN 1262 3/PG 2

wgk germany：

hazard class code：

11-38-50/53-65-67

safety instructions：

60-61-62-33-29-16-9

Marks：

F,Xn,N

Precautionary statement(s)：

P210-P261-P273-P301 + P310-P331-P501

Hazard Statements：

H225-H304-H315-H336-H410

Drug Information

MeSH Entry Terms：

22(29)-hopene

Diploptene Use and Manufacturing

Use Classification：

Lipids -> Prenol Lipids [PR] -> Hopanoids [PR04]

Computed Properties

Molecular Weight:410.7
XLogP3:11.4
Rotatable Bond Count:1
Exact Mass:410.391251595
Monoisotopic Mass:410.391251595
Heavy Atom Count:30
Complexity:730
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes