| Identification | More | [Name]
16-Dehydroprogesterone | [CAS]
1096-38-4 | [Synonyms]
16-DEHYDROPROGESTERONE
4,16-PREGNADIEN-3,20-DIONE
4,16-PREGNADIENE-3,20-DIONE
pregna-4,16-diene-3,20-dione
16-DEHYDROPROGESTERONE CRYSTALLINE
17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-3-one
17-Acetylandrosta-4,16-diene-3-one
NSC-11037
ZK-47520 | [EINECS(EC#)]
214-142-8 | [Molecular Formula]
C21H28O2 | [MDL Number]
MFCD00003651 | [Molecular Weight]
312.45 | [MOL File]
1096-38-4.mol |
| Chemical Properties | Back Directory | [Melting point ]
185-187 °C(lit.) | [Boiling point ]
461.0±45.0 °C(Predicted) | [density ]
1.10±0.1 g/cm3(Predicted) | [storage temp. ]
2-8°C | [solubility ]
Chloroform (Slightly), DMSO (Slightly, Sonicated), Methanol (Slightly) | [form ]
Solid | [color ]
Off-White to Pale Yellow | [InChI]
InChI=1S/C21H28O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h6,12,16,18-19H,4-5,7-11H2,1-3H3/t16-,18-,19-,20-,21+/m0/s1 | [InChIKey]
VRRHHTISESGZFN-RKFFNLMFSA-N | [SMILES]
C1(=O)C=C2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)C(C(=O)C)=CC3)CC2 | [CAS DataBase Reference]
1096-38-4(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xn | [Risk Statements ]
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R40:Limited evidence of a carcinogenic effect. | [Safety Statements ]
S22:Do not breathe dust .
S36:Wear suitable protective clothing . | [WGK Germany ]
3
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| Hazard Information | Back Directory | [Uses]
16-Dehydroprogesterone is used in the direct organocatalytic stereoselective transfer hydrogenation of conjugated olefins of steroids. 16-Dehydroprogesterone is a form of Progesterone (P755900), a steroid hormone produced by the corpus luteum that induces maturation and secretory activity of the uterine endothelium; suppresses ovulation. Progesterone is implicated in the etiology of breast cancer. | [Definition]
ChEBI: 16,17-didehydroprogesterone is a 20-oxo steroid, a 3-oxo-Delta(4) steroid and an enone. It is functionally related to a progesterone. |
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