(5S)-3-[(2R)-7-[5-[1,4-Dihydroxy-4-[tetrahydro-5-(1-hydroxyundecyl)-2-furanyl]butyl]tetrahydro-2-furanyl]-2-hydroxyheptyl]-5-methyl-2(5H)-furanone

CAS Registry Number®

189747-98-6

CAS Name

(5S)-3-[(2R)-7-[5-[1,4-Dihydroxy-4-[tetrahydro-5-(1-hydroxyundecyl)-2-furanyl]butyl]tetrahydro-2-furanyl]-2-hydroxyheptyl]-5-methyl-2(5H)-furanone

Molecular Formula

C35H62O8

Molecular Mass

610.86

Cite this Page

(5S)-3-[(2R)-7-[5-[1,4-Dihydroxy-4-[tetrahydro-5-(1-hydroxyundecyl)-2-furanyl]butyl]tetrahydro-2-furanyl]-2-hydroxyheptyl]-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=189747-98-6 (retrieved 2024-11-25) (CAS RN: 189747-98-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C35H62O8/c1-3-4-5-6-7-8-9-13-16-29(37)33-21-22-34(43-33)31(39)19-18-30(38)32-20-17-28(42-32)15-12-10-11-14-27(36)24-26-23-25(2)41-35(26)40/h23,25,27-34,36-39H,3-22,24H2,1-2H3/t25-,27+,28?,29?,30?,31?,32?,33?,34?/m0/s1

InChIKey

InChIKey=FTBUPRVFMAYNFL-DOUKICFESA-N

SMILES

C(CCC(O)C1OC(CCCCC[C@H](CC=2C(=O)O[C@@H](C)C2)O)CC1)(O)C3OC(C(CCCCCCCCCC)O)CC3

Canonical SMILES

O=C1OC(C=C1CC(O)CCCCCC2OC(CC2)C(O)CCC(O)C3OC(CC3)C(O)CCCCCCCCCC)C

Other Names for this Substance

  • 2(5H)-Furanone, 3-[(2R)-7-[5-[1,4-dihydroxy-4-[tetrahydro-5-(1-hydroxyundecyl)-2-furanyl]butyl]tetrahydro-2-furanyl]-2-hydroxyheptyl]-5-methyl-, (5S)-
  • 2(5H)-Furanone, 3-[7-[5-[1,4-dihydroxy-4-[tetrahydro-5-(1-hydroxyundecyl)-2-furanyl]butyl]tetrahydro-2-furanyl]-2-hydroxyheptyl]-5-methyl-, [2[R(S)]]-[partial]-
  • (5S)-3-[(2R)-7-[5-[1,4-Dihydroxy-4-[tetrahydro-5-(1-hydroxyundecyl)-2-furanyl]butyl]tetrahydro-2-furanyl]-2-hydroxyheptyl]-5-methyl-2(5H)-furanone
  • Trilobalicin

CAS INSIGHTSTM
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