Chemical Compound

Orthosphenic acid

CAS Registry Number 86632-20-4
Orthosphenic acid chemical structure
Primary Record

Orthosphenic acid

In stock
7,392 g
Purity
99.2 %
CAS
86632-20-4

Compound Identifiers & Properties

CAS
86632-20-4
PubChem CID
20056194
SMILES
C[C@@H]1[C@@]23CC[C@H]4[C@]([C@@H]2C[C@H]([C@@]1(OC3)O)O)(CC[C@@]5([C@@]4(CC[C@@]6([C@H]5C[C@](CC6)(C)C(=O)O)C)C)C)C
Canonical SMILES
C[C@@H]1[C@@]23CC[C@H]4[C@@](C)(CC[C@@]5(C)[C@@H]6C[C@](C)(C(=O)O)CC[C@]6(C)CC[C@]45C)[C@@H]2C[C@@H](O)[C@]1(O)OC3

Names & Synonyms

  • Orthosphenic acid
  • Orthophenic acid
  • RefChem:168627
  • 86632-20-4
  • CHEMBL515079
  • CHEBI:132615
  • SCHEMBL2396346
  • C30H45O5
  • C30H48O5
  • BDBM50242237
  • NP7183
  • AKOS040763667
  • C30-H45-O5
  • FO65581
  • AC-35123
  • DA-76466
  • TS-10155
  • (1R,4S,5R,8S,11R,13R,14S,17R,18S,20R,21R,24R)-20,21-dihydroxy-5,8,11,14,17,24-hexamethyl-22-oxahexacyclo[19.2.1.01,18.04,17.05,14.08,13]tetracosane-11-carboxylic acid
  • J1.932.900C
  • 2alpha,3alpha-Dihydroxy-3beta,24-epoxy-D:A-friedooleanane-29-oic acid
  • 2H-3,4a-(Epoxymethano)picene-11-carboxylic acid, eicosahydro-2,3-dihydroxy-4,6b,8,11,12b,14a-hexamethyl-, (2R-(2-alpha,3-beta,4-beta,4a-beta,6a-alpha,6b-beta,8a-beta,11-alpha,12a-beta,12b-alpha,14a-beta,14b-alpha))-
  • (1R,4S,5R,8S,11R,13R,14S,17R,18S,20R,21R,24R)-20,21-dihydroxy-5,8,11,14,17,24-hexamethyl-22-oxahexacyclo(19.2.1.01,18.04,17.05,14.08,13)tetracosane-11-carboxylic acid
  • (1R,4S,5R,8S,11R,13R,14S,17R,18S,20R,21R,24R)-20,21-dihydroxy-5,8,11,14,17,24-hexamethyl-22-oxahexacyclo[19.2.1.0(1),(1)?.0?,(1)?.0?,(1)?.0?,(1)(3)]tetracosane-11-carboxylic acid
  • (2R,3R,4R,4aR,6aS,6bR,8aS,11R,12aR,12bS,14aR,14bS)-Eicosahydro-2,3-dihydroxy-4,6b,8a,11,12b,14a-hexamethyl-2H-3,4a-(epoxymethano)picene-11-carboxylic acid
  • (2R,3R,5aR,7aS,7bR,9aS,12R,13aR,13bS,15aR,15bS,16R)-2,3-dihydroxy-7b,9a,12,13b,15a,16-hexamethylicosahydro-5H-3,5a-methanochryseno[2,1-c]oxepine-12-carboxylic acid