(25S)-Antcin B

Category	SARS-CoV
CAS	1312711-71-9

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Synonyms	(25S)-Antcin B;Antcamphin I;163597-25-9;CHEMBL446448;SCHEMBL11885911;DTXSID80659015;CHEBI:204475;HY-N12384;(4alpha,5alpha,25S)-4-Methyl-3,7,11-trioxoergosta-8,24(28)-dien-26-oic acid;DA-48639;CS-0901057;(2S,6R)-2-methyl-3-methylidene-6-[(4S,5S,10S,13R,14R,17R)-4,10,13-trimethyl-3,7,11-trioxo-1,2,4,5,6,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]heptanoic acid;1312711-71-9;
IUPAC Name	(2S,6R)-2-methyl-3-methylidene-6-[(4S,5S,10S,13R,14R,17R)-4,10,13-trimethyl-3,7,11-trioxo-1,2,4,5,6,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]heptanoic acid
Molecular Weight	468.62
Molecular Formula	C29H40O5
Canonical SMILES	C[C@@]12C3=C(C(C[C@@]1([H])[C@@H](C(CC2)=O)C)=O)[C@@]4([H])[C@](CC3=O)([C@@](CC4)([H])[C@H](C)CCC([C@H](C)C(O)=O)=C)C
InChI	InChI=1S/C29H40O5/c1-15(17(3)27(33)34)7-8-16(2)19-9-10-20-25-23(31)13-21-18(4)22(30)11-12-28(21,5)26(25)24(32)14-29(19,20)6/h16-21H,1,7-14H2,2-6H3,(H,33,34)/t16-,17+,18+,19-,20+,21+,28+,29-/m1/s1
InChIKey	DVORYMAGXQGBQK-HPRYJKPLSA-N
Storage	Please store the product under the recommended conditions in the Certificate of Analysis.