L-Ascorbic acid, 2-[(3β)-cholest-5-en-3-yl hydrogen phosphate], sodium salt (1:1)
CAS Registry Number®
185018-43-3
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CAS Name
L-Ascorbic acid, 2-[(3β)-cholest-5-en-3-yl hydrogen phosphate], sodium salt (1:1)Molecular Formula
C33H53O9P.NaCite this Page
L-Ascorbic acid, 2-[(3β)-cholest-5-en-3-yl hydrogen phosphate], sodium salt (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=185018-43-3 (retrieved ) (CAS RN: 185018-43-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C33H53O9P.Na/c1-19(2)7-6-8-20(3)24-11-12-25-23-10-9-21-17-22(13-15-32(21,4)26(23)14-16-33(24,25)5)41-43(38,39)42-30-28(36)29(27(35)18-34)40-31(30)37;/h9,19-20,22-27,29,34-36H,6-8,10-18H2,1-5H3,(H,38,39);/t20-,22+,23+,24-,25+,26+,27+,29-,32+,33-;/m1./s1
InChIKey
InChIKey=XVOLXZBTKWCFFO-JFDGLQCVSA-N
SMILES
C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@]([C@@H](CCCC(C)C)C)(CC4)[H])[H])(CC=C1C[C@@H](OP(OC5=C(O)[C@@]([C@H](CO)O)(OC5=O)[H])(=O)O)CC2)[H])[H].[Na]
Canonical SMILES
[Na].O=C1OC(C(O)=C1OP(=O)(O)OC2CC3=CCC4C(CCC5(C)C(CCC45)C(C)CCCC(C)C)C3(C)CC2)C(O)CO
Other Names for this Substance
- L-Ascorbic acid, 2-[(3β)-cholest-5-en-3-yl hydrogen phosphate], sodium salt (1:1)
- L-Ascorbic acid, 2-[(3β)-cholest-5-en-3-yl hydrogen phosphate], monosodium salt
