(21R)-3β,12β,16β-Trihydroxy-21-methyl-30-nor-A/'-neogammaceran-22-one


CAS No. : 11049-57-3

(21R)-3β,12β,16β-Trihydroxy-21-methyl-30-nor-A/
Product Details
Cat No:M064406
Molecular Formula:C30H50O4
Molecular Weight:474.726
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Cat No:M064406
Cas No:11049-57-3
Product-Name:(21R)-3β,12β,16β-Trihydroxy-21-methyl-30-nor-A/'-neogammaceran-22-one
IUPAC Name:1-[(3R,3aR,4S,5aR,5bR,7aR,9S,11aR,11bR,13R,13aR,13bR)-4,9,13-trihydroxy-3,5a,5b,8,8,11a,13b-heptamethyl-2,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-tetradecahydro-1H-cyclopenta[a]chrysen-3-yl]ethanone
InChI:InChI=1S/C30H50O4/c1-17(31)26(4)13-14-28(6)23(26)19(33)16-30(8)24(28)18(32)15-21-27(5)11-10-22(34)25(2,3)20(27)9-12-29(21,30)7/h18-24,32-34H,9-16H2,1-8H3/t18-,19+,20+,21-,22+,23+,24-,26+,27+,28+,29-,30-/m1/s1
InChIKey:AWCCLWPHALOMSP-JCIKFPHQSA-N
SMILES:CC(=O)C1(CCC2(C1C(CC3(C2C(CC4C3(CCC5C4(CCC(C5(C)C)O)C)C)O)C)O)C)C
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