16a,17a-Epoxyprogesterone

CAS

1097-51-4

Catalog Number

ACM1097514

Category

Steroidal Compounds

Molecular Weight

328.45

Molecular Formula

C₂₁H₂₈O₃

MSDS COA Spec Sheet

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Specification

Synonyms

16,17-EPOXYPROGESTERONE; 16Alpha,17Alpha-Epoxyprogesterone; W-oxide; 16α,17α-Epoxy-4-pregnen-3,20-dione; ZK-5197; EPOXY PROGESTERONE; 16α,17α-Epoxyprogesterone; 16a,17a-Epoxy-4-Pregnen-3,20-Dione; 16,17-Epoxyprogesterone; 16alpha,17-Epoxyprogesterone; 16,17a-Epoxyprogesterone; 16A,17A-EPOXY PROGESTERONE; 16a,17a-Epoxyprogest;

IUPAC Name

16a,17a-Epoxyprogesterone

Canonical SMILES

CC(=O)C12C(O1)CC3C2(CCC4C3CCC5=CC(=O)CCC45C)C

InChI Key

LHNVKVKZPHUYQO-SRWWVFQWSA-N

Boiling Point

466.9ºC at 760 mmHg

Melting Point

128 to 132ºC

Flash Point

204.4ºC

Density

1.18 g/cm³

Appearance

white or white crystalline powder

EC Number

214-147-5

Exact Mass

328.20400

WGK Germany

What is the molecular formula of 16a,17a-Epoxyprogesterone?

The molecular formula of 16a,17a-Epoxyprogesterone is C21H28O3.

What is the PubChem CID of 16a,17a-Epoxyprogesterone?

The PubChem CID of 16a,17a-Epoxyprogesterone is 101966.

When was 16a,17a-Epoxyprogesterone created in PubChem?

16a,17a-Epoxyprogesterone was created in PubChem on 2005-03-26.

What is the molecular weight of 16a,17a-Epoxyprogesterone?

The molecular weight of 16a,17a-Epoxyprogesterone is 328.4 g/mol.

What is the IUPAC Name of 16a,17a-Epoxyprogesterone?

The IUPAC Name of 16a,17a-Epoxyprogesterone is (1R,2S,4R,6S,7S,10S,11R)-6-acetyl-7,11-dimethyl-5-oxapentacyclo[8.8.0.02,7.04,6.011,16]octadec-15-en-14-one.

What is the InChI key of 16a,17a-Epoxyprogesterone?

The InChI key of 16a,17a-Epoxyprogesterone is LHNVKVKZPHUYQO-SRWWVFQWSA-N.

What is the Canonical SMILES of 16a,17a-Epoxyprogesterone?

The Canonical SMILES of 16a,17a-Epoxyprogesterone is CC(=O)C12C(O1)CC3C2(CCC4C3CCC5=CC(=O)CCC45C).

What is the CAS number of 16a,17a-Epoxyprogesterone?

The CAS number of 16a,17a-Epoxyprogesterone is 1097-51-4.

What is the KEGG ID of 16a,17a-Epoxyprogesterone?

The KEGG ID of 16a,17a-Epoxyprogesterone is C14681.

What is the XLogP3-AA value of 16a,17a-Epoxyprogesterone?

The XLogP3-AA value of 16a,17a-Epoxyprogesterone is 2.9.