PDB CCD ID: | GR3 | ||||||||||||
Number of entries in BioLiP: | 2 | ||||||||||||
Chemical formula: | C32 H46 O7 | ||||||||||||
InChI: | InChI=1S/C32H46O7/c1-18(2)14-21(35)15-20(17-33)27-24(36)16-31(6)23-8-9-25-29(4,22(23)10-13-30(27,31)5)12-11-26(39-19(3)34)32(25,7)28(37)38/h8,14,17,20,22,24-27,36H,9-13,15-16H2,1-7H3,(H,37,38)/t20-,22-,24-,25+,26+,27+,29+,30-,31+,32-/m0/s1 | ||||||||||||
InChIKey: | MKGUGMKLWZNKQT-DWJUSYOASA-N | ||||||||||||
SMILES: |
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Name: | 3-ACETOXY-17-(1-FORMYL-5-METHYL-3-OXO-HEX-4-ENYL)-16-HYDROXY-4,10,13,14-TETRAMETHYL-2,3,4,5,6,9,10,11,12,13,14,15,16,17-TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHRENE-4-CARBOXYLIC ACID | ||||||||||||
ZINC: | ZINC000037858498 |