(5S)-3-[(2R,13R)-2,13-Dihydroxy-13-[(2R,2′R,5R,5′R)-octahydro-5′-[(1R)-1-hydroxyundecyl][2,2′-bifuran]-5-yl]tridecyl]-5-methyl-2(5H)-furanone
CAS Registry Number®
102989-24-2
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CAS Name
(5S)-3-[(2R,13R)-2,13-Dihydroxy-13-[(2R,2′R,5R,5′R)-octahydro-5′-[(1R)-1-hydroxyundecyl][2,2′-bifuran]-5-yl]tridecyl]-5-methyl-2(5H)-furanoneMolecular Formula
C37H66O7Molecular Mass
622.92Cite this Page
(5S)-3-[(2R,13R)-2,13-Dihydroxy-13-[(2R,2′R,5R,5′R)-octahydro-5′-[(1R)-1-hydroxyundecyl][2,2′-bifuran]-5-yl]tridecyl]-5-methyl-2(5H)-furanone. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=102989-24-2 (retrieved ) (CAS RN: 102989-24-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
45-48 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C37H66O7/c1-3-4-5-6-7-11-14-17-20-31(39)33-22-24-35(43-33)36-25-23-34(44-36)32(40)21-18-15-12-9-8-10-13-16-19-30(38)27-29-26-28(2)42-37(29)41/h26,28,30-36,38-40H,3-25,27H2,1-2H3/t28-,30+,31+,32+,33+,34+,35+,36+/m0/s1
InChIKey
InChIKey=MBABCNBNDNGODA-UOCXRWNNSA-N
SMILES
[C@H](CCCCCCCCCC[C@H](CC=1C(=O)O[C@@H](C)C1)O)(O)[C@@]2(O[C@](CC2)([C@@]3(O[C@@]([C@@H](CCCCCCCCCC)O)(CC3)[H])[H])[H])[H]
Canonical SMILES
O=C1OC(C=C1CC(O)CCCCCCCCCCC(O)C2OC(CC2)C3OC(CC3)C(O)CCCCCCCCCC)C
Other Names for this Substance
- 2(5H)-Furanone, 3-[(2R,13R)-2,13-dihydroxy-13-[(2R,2′R,5R,5′R)-octahydro-5′-[(1R)-1-hydroxyundecyl][2,2′-bifuran]-5-yl]tridecyl]-5-methyl-, (5S)-
- 2(5H)-Furanone, 3-[2,13-dihydroxy-13-[octahydro-5′-(1-hydroxyundecyl)[2,2′-bifuran]-5-yl]tridecyl]-5-methyl-, [2R-[2α[2′R*,5′R*(R*)],5β[2R*(S*),13R*]]]-
- (5S)-3-[(2R,13R)-2,13-Dihydroxy-13-[(2R,2′R,5R,5′R)-octahydro-5′-[(1R)-1-hydroxyundecyl][2,2′-bifuran]-5-yl]tridecyl]-5-methyl-2(5H)-furanone
- Asimicin
- Squamocin H
Deleted or Replaced CAS Registry Numbers
159993-36-9