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ATRA-BA Hybrid

Description: ATRA-BA Hybrid is a prodrug form of all-trans retinoic acid and butyric acid.

Name: ATRA-BA Hybrid
CAS#: 1037543-26-2
Chemical Formula: C31H40O4
Exact Mass: 476.2927
Molecular Weight: 476.657
Elemental Analysis: C, 78.12; H, 8.46; O, 13.43

Synonym: ATRA-BA Hybrid; ATRA BA Hybrid

IUPAC/Chemical Name: 4-((butyryloxy)methyl)phenyl (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoate

InChi Key: GDELUZOQMHQHNF-PFLGVXPYSA-N

InChi Code: InChI=1S/C31H40O4/c1-7-10-29(32)34-22-26-15-17-27(18-16-26)35-30(33)21-24(3)12-8-11-23(2)14-19-28-25(4)13-9-20-31(28,5)6/h8,11-12,14-19,21H,7,9-10,13,20,22H2,1-6H3/b12-8+,19-14+,23-11+,24-21+

SMILES Code: CC1(C)C(/C=C/C(C)=C/C=C/C(C)=C/C(OC2=CC=C(COC(CCC)=O)C=C2)=O)=C(C)CCC1

Appearance: Solid powder

Purity: >98% (or refer to the Certificate of Analysis)

Shipping Condition: Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.

Storage Condition: Dry, dark and at 0 – 4 C for short term (days to weeks) or -20 C for long term (months to years).

Solubility: Soluble in DMSO

Shelf Life: >3 years if stored properly

Drug Formulation: This drug may be formulated in DMSO

Stock Solution Storage: 0 – 4 C for short term (days to weeks), or -20 C for long term (months).

HS Tariff Code: 2934.99.9001

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