compound 0048124

Properties Image MNX_ID MNXM1178442 reference envipathM:...34cabf2c05a9 formula C19H30O3 global charge 0 mol weight 306.446 InChIKey GKLKJNHNLNFJOP-RCQBSMPUSA-N InChI InChI=1S/C19H30O3/c1-17-8-5-13(20)11-12(17)3-4-15-14(17)6-9-18(2)16(21)7-10-19(15,18)22/h12,14-16,21-22H,3-11H2,1-2H3/t12?,14?,15?,16?,17-,18+,19?/m0/s1 SMILES C[C@]12CCC(=O)CC1CCC1C2CC[C@]2(C)C(O)CCC12O MNX internals InChI (mnx) InChI=1/C19H30O3/c1-17-8-5-13(20)11-12(17)3-4-15-14(17)6-9-18(2)16(21)7-10-19(15,18)22/h12,14-16,21-22H,3-11H2,1-2H3/t12?,14?,15?,16?,17-,18+,19?/m0/s1 SMILES (mnx) [CH3:1][C@:17]12[CH2:8][CH2:5][C:13](=[O:20])[CH2:11][CH:12]1[CH2:3][CH2:4][CH:15]1[CH:14]2[CH2:6][CH2:9][C@:18]2([CH3:2])[CH:16]([OH:21])[CH2:7][CH2:10][C:19]12[OH:22]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0