Lasalocid A

CAS Registry Number®

25999-31-9

CAS Name

Lasalocid A

Molecular Formula

C34H54O8

Molecular Mass

590.79

Cite this Page

Lasalocid A.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=25999-31-9 (retrieved 2024-11-21) (CAS RN: 25999-31-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    110-114 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C34H54O8/c1-9-25(31-21(6)18-34(11-3,42-31)26-16-17-33(40,10-2)23(8)41-26)30(37)22(7)28(35)19(4)12-14-24-15-13-20(5)29(36)27(24)32(38)39/h13,15,19,21-23,25-26,28,31,35-36,40H,9-12,14,16-18H2,1-8H3,(H,38,39)/t19-,21+,22+,23+,25+,26-,28+,31+,33-,34+/m1/s1

InChIKey

InChIKey=BBMULGJBVDDDNI-OWKLGTHSSA-N

SMILES

C(C)[C@@]1(O[C@]([C@H](C([C@H]([C@H]([C@@H](CCC2=C(C(O)=O)C(O)=C(C)C=C2)C)O)C)=O)CC)([C@@H](C)C1)[H])[C@@]3(O[C@@H](C)[C@](CC)(O)CC3)[H]

Canonical SMILES

O=C(O)C1=C(O)C(=CC=C1CCC(C)C(O)C(C(=O)C(CC)C2OC(CC)(CC2C)C3OC(C)C(O)(CC)CC3)C)C

Other Names for this Substance

  • Benzoic acid, 6-[(3R,4S,5S,7R)-7-[(2S,3S,5S)-5-ethyl-5-[(2R,5R,6S)-5-ethyltetrahydro-5-hydroxy-6-methyl-2H-pyran-2-yl]tetrahydro-3-methyl-2-furanyl]-4-hydroxy-3,5-dimethyl-6-oxononyl]-2-hydroxy-3-methyl-
  • Benzoic acid, 6-[7-[5-ethyl-5-(5-ethyltetrahydro-5-hydroxy-6-methyl-2H-pyran-2-yl)tetrahydro-3-methyl-2-furanyl]-4-hydroxy-3,5-dimethyl-6-oxononyl]-2-hydroxy-3-methyl-, [2R-[2α[2S*(3R*,4S*,5S*,7R*),3S*,5S*],5α,6β]]-
  • 2,3-Cresotic acid, 6-[7-[5-ethyl-5-(5-ethyltetrahydro-5-hydroxy-6-methyl-2H-pyran-2-yl)tetrahydro-3-methyl-2-furyl]-4-hydroxy-3,5-dimethyl-6-oxononyl]-, (-)-
  • 6-[(3R,4S,5S,7R)-7-[(2S,3S,5S)-5-Ethyl-5-[(2R,5R,6S)-5-ethyltetrahydro-5-hydroxy-6-methyl-2H-pyran-2-yl]tetrahydro-3-methyl-2-furanyl]-4-hydroxy-3,5-dimethyl-6-oxononyl]-2-hydroxy-3-methylbenzoic acid
  • X 537A

View All

Deleted or Replaced CAS Registry Numbers

107684-72-0, 26934-10-1, 37213-87-9, 37259-88-4, 802620-47-9

CAS INSIGHTSTM
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