CDDU-Me

Himiki ady:

metil (1S, 2R, 4aS, 6aR, 6bS, 8aR, 12aS, 14aR, 14bS) -11-siano-1,2,6a, 6b, 9,9,12a-heptametil-10,14-d ioxo-1,3,4,5,6,6a, 6b, 7,8,8a, 9,10,12a, 14,14a, 14b-heksadecahydropicene-4a (2H) -karboksilat

SMILES kody:

O = C1C (C # N) = C [C @@] 2 (C) [C @] (CC [C @] ([C @@] 3 (C) [C @@] 4 ([H]) [C @@] 5 ​​([H] ) [C @@] (CC [C @@ H] (C) [C @@ H] 5C) (C (OC) = O) CC3) (C) C2 = CC4 = O) ([H]) C1 (C) C.

InChi kody:

InChI = 1S / C32H43NO4 / c1-18-9-12-32 (27 (36) 37-8) 14-13-31 (7) 25 (24 (32) 19 (18) 2) 21 (34) 15- 23-29 (5) 16-20 (17-33) 26 (35) 28 (3,4) 22 (29) 10-11-30 (23,31) 6 / h15-16,18-19,22,24-25H, 9-14H2,1-8H3 / t18-, 19 +, 22 +, 24 +, 25-, 29 +, 30-, 31-, 32 + / m1 / s1

InChi açary:

FBFIPYQVVRWCIY-VPQHEVHVSA-N

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