For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5β-pregnane-3α,6α,20β,21-tetrol, tetrracetate
SpectraBase Compound ID 8ViYAYS62Pj
InChI InChI=1S/C29H44O8/c1-16(30)34-15-27(37-19(4)33)24-8-7-22-21-14-26(36-18(3)32)25-13-20(35-17(2)31)9-11-29(25,6)23(21)10-12-28(22,24)5/h20-27H,7-15H2,1-6H3/t20-,21+,22+,23+,24-,25+,26+,27-,28+,29-/m1/s1
InChIKey XFDOUEPGPGYZDK-CTWCCQBJSA-N
Mol Weight 520.7 g/mol
Molecular Formula C29H44O8
Exact Mass 520.303618 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 34Cqe8Od0Dx
Name 5β-pregnane-3α,6α,20β,21-tetrol, tetrracetate
Source of Sample M. L. LEWBART, CROZER-CHESTER MEDICAL CENTER, CHESTER, PENNSYLVANIA
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H44O8
InChI InChI=1S/C29H44O8/c1-16(30)34-15-27(37-19(4)33)24-8-7-22-21-14-26(36-18(3)32)25-13-20(35-17(2)31)9-11-29(25,6)23(21)10-12-28(22,24)5/h20-27H,7-15H2,1-6H3/t20-,21+,22+,23+,24-,25+,26+,27-,28+,29-/m1/s1
InChIKey XFDOUEPGPGYZDK-CTWCCQBJSA-N
Literature Reference J. BIOL. CHEM. 241, 5325(1966) Abstract-Chemical Abstracts= 65, 18939D(1966)
Melting Point 153.5-155C
Molecular Weight 520.663025
Synonyms 5B-PREGNANE-3A,6A,20B,21-TETROL, TETRAACETATE
Technique KBr WAFER