CAS Registry Number®
115074-43-6
CAS Name
Calcium mupirocin dihydrate
Molecular Formula
C26H44O9.1/2Ca.H2O
Compound Properties
-
Melting Point (1)
132-139 °C
Source(s)
- (1) Nakagawa, Koji; Kagaku Ryoho no Ryoiki, (1996), 12(7), 1293-1296, CAplus
Other Names and Identifiers
InChI
InChI=1S/C26H44O9.Ca.H2O/c1-16(13-23(30)33-11-9-7-5-4-6-8-10-22(28)29)12-20-25(32)24(31)19(15-34-20)14-21-26(35-21)17(2)18(3)27;;/h13,17-21,24-27,31-32H,4-12,14-15H2,1-3H3,(H,28,29);;1H2/b16-13+;;/t17-,18-,19-,20-,21-,24+,25-,26-;;/m0../s1
InChIKey
InChIKey=BLZJSZDYKXDOEQ-MJJSANMQSA-N
SMILES
C([C@H]1[C@]([C@H]([C@H](C)O)C)(O1)[H])[C@@H]2[C@@H](O)[C@@H](O)[C@H](C/C(=C/C(OCCCCCCCCC(O)=O)=O)/C)OC2.[Ca].O
Canonical SMILES
[Ca].O=C(O)CCCCCCCCOC(=O)C=C(C)CC1OCC(CC2OC2C(C)C(O)C)C(O)C1O.O
Other Names for this Substance
- L–talo-Non-2-enonic acid, 5,9-anhydro-2,3,4,8-tetradeoxy-8-[(2S,3S)-[3-[(1S,2S)-2-hydroxy-1-methylpropyl]-2-oxiranyl]methyl]-3-methyl-, 8-carboxyoctyl ester, calcium salt, hydrate (2:1:2)
- L–talo-Non-2-enonic acid, 5,9-anhydro-2,3,4,8-tetradeoxy-8-[[3-(2-hydroxy-1-methylpropyl)oxiranyl]methyl]-3-methyl-, 8-carboxyoctyl ester, calcium salt (2:1), dihydrate, [2E,8[2S,3S(1S,2S)]]-
- Calcium mupirocin dihydrate
- Mupirocin calcium hydrate
- Mupirocin calcium dihydrate
Deleted or Replaced CAS Registry Numbers
573951-40-3
