Products 193684-74-1

CAS 193684-74-1 appears in our catalog under these names: wilforic acid A, Wilforic acid A. Offered by: GLPBio, MedChemExpress. Available pack sizes: 5mg, Get quote.

wilforic acid A
GLPBio
  • size: 5mg
  • Variants: 1
from 2731.35
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Wilforic acid A
MedChemExpress
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  • Variants: 1
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Structural formula: {0} (CAS {1})

Wilforic acid is a pentacyclic triterpenoid with formula C29H42O4, originally isolated from Tripterygium sp. It has a role as a plant metabolite. It is a pentacyclic triterpenoid, a member of catechols and a hydroxy monocarboxylic acid.

Source: ChEBI

Identity
Molecular formulaC29H42O4
Molecular weight454.6 g/mol
IUPAC name(2R,4aS,6aR,6aR,6bR,14aS,14bR)-10,11-dihydroxy-2,4a,6a,6a,9,14a-hexamethyl-3,4,5,6,6b,7,8,13,14,14b-decahydro-1H-picene-2-carboxylic acid
InChIKeyNBMIXMLIGPLJPK-KHYSSQCESA-N
SMILESCC1=C2CC[C@H]3[C@](C2=CC(=C1O)O)(CC[C@@]4([C@@]3(CC[C@@]5([C@H]4C[C@](CC5)(C)C(=O)O)C)C)C)C

Computed by PubChem (NCBI)

Synonyms: wilforic acid A, Wilforic acid, orb2663469
Isomers (same molecular formula)
1,3-bis(phenylmethoxy)propan-2-yl dodecanoate C29H42O4
2,3-dimethoxy-5-methyl-6-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]cyclohexa-2,5-diene-1,4-dione C29H42O4
(6R)-2-methyl-3-methylidene-6-[(4S,5S,10S,13R,14R,17R)-4,10,13-trimethyl-3,11-dioxo-2,4,5,6,7,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]heptanoic acid C29H42O4
(2E,6E,10E)-13-[(2R)-6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl]-2,6,10-trimethyltrideca-2,6,10-trienoic acid C29H42O4
10-hydroxy-2,4a,6a,8a,9,14a-hexamethyl-11-oxo-1,3,4,5,6,6a,6b,7,8,13,14,14b-dodecahydropicene-2-carboxylic acid C29H42O4