Product Code

TRC-M289475

CAS Number

595-77-7

Product Format

Neat

Molecular Formula

C21 H30 O4

Molecular Weight

346.46

Product Categories

TRC, API Reference Standards & Research Materials

Product Type

API

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Algestone

CAS Number

595-77-7

Molecular Formula

C21 H30 O4

Molecular Weight

346.46

Accurate Mass

346.2144

SMILES

CC(=O)[C@@]1(O)[C@H](O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C

InChI

InChI=1S/C21H30O4/c1-12(22)21(25)18(24)11-17-15-5-4-13-10-14(23)6-8-19(13,2)16(15)7-9-20(17,21)3/h10,15-18,24-25H,4-9,11H2,1-3H3/t15-,16+,17+,18-,19+,20+,21-/m1/s1

IUPAC

(8R,9S,10R,13S,14S,16R,17S)-17-acetyl-16,17-dihydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one

Product Data

Country of Origin

CANADA

Product Format

Neat

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Methyl 2-Amino-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

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