化学式

CAS号

IUPAC Name

(E,6R)-8-[(1S,3E,7E,14R,16S,17R,18R,20E,22R,24R,26R,28R,29E,33Z,37S,38R,42R)-16-羟基-17,42-二甲基-11,35-二氧代-10,12,23,27,36,39,43-heptaoxahexacyclo[35.2.2.114,18.122,26.09,13.024,28]tritetraconta-3,7,20,29,31,33,40-heptaen-38-基]-6-甲基-7-烯酸 (E,6R)-8-[(1S,3E,7E,14R,16S,17R,18R,20E,22R,24R,26R,28R,29E,33Z,37S,38R,42R)-16-hydroxy-17,42-dimethyl-11,35-dioxo-10,12,23,27,36,39,43-heptaoxahexacyclo[35.2.2.114,18.122,26.09,13.024,28]tritetraconta-3,7,20,29,31,33,40-heptaen-38-yl]-6-methylnon-7-enoic acid

InChI

InChI=1S/C48H64O12/c1-30(17-14-15-23-44(50)51)27-31(2)46-40-26-25-34(54-46)18-10-6-5-7-12-20-39-47(60-48(53)59-39)43-28-35(49)32(3)36(56-43)21-16-22-37-33(4)41-29-42(55-37)38(57-41)19-11-8-9-13-24-45(52)58-40/h6,8-13,16,19-20,22,24-27,30,32-43,46-47,49H,5,7,14-15,17-18,21,23,28-29H2,1-4H3,(H,50,51)/b9-8?,10-6+,19-11+,20-12+,22-16+,24-13-,31-27+/t30-,32-,33+,34+,35+,36-,37-,38-,39?,40+,41-,42-,43-,46-,47?/m1/s1

InChI Key

XUCZZKIQZJBNKG-LYJNXDTRSA-N

Canonical SMILES

CC1C2CC=CC3C(C4CC(O3)C(O4)C=CC=CC=CC(=O)OC5C=CC(CC=CCCC=CC6C(C(O2)CC1O)OC(=O)O6)OC5C(=CC(C)CCCCC(=O)O)C)C

别名