(E,4S)-13-[(2R)-2,8-dimethyl-6-oxidanyl-3,4-dihydrochromen-2-yl]-2,6,10-trimethyl-4-oxidanyl-tridec-10-en-5-one

Systemtic Name: (E,4S)-13-[(2R)-2,8-dimethyl-6-oxidanyl-3,4-dihydrochromen-2-yl]-2,6,10-trimethyl-4-oxidanyl-tridec-10-en-5-one Openeye Name: (E,4S)-4-hydroxy-13-[(2R)-6-hydroxy-2,8-dimethyl-chroman-2-yl]-2,6,10-trimethyl-tridec-10-en-5-one CAS Name: (E,4S)-4-hydroxy-13-[(2R)-6-hydroxy-2,8-dimethyl-3,4-dihydro-2H-1-benzopyran-2-yl]-2,6,10-trimethyl-10-tridecen-5-one IUPAC Name: (E,4S)-4-hydroxy-13-[(2R)-6-hydroxy-2,8-dimethyl-3,4-dihydrochromen-2-yl]-2,6,10-trimethyltridec-10-en-5-one Traditional Name: (E,4S)-4-hydroxy-13-[(2R)-6-hydroxy-2,8-dimethyl-chroman-2-yl]-2,6,10-trimethyl-tridec-10-en-5-one Formula: C27H42O4 MolecularWeight: 430.61998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)O)CCC(O2)(C)CCC=C(C)CCCC(C)C(=O)C(CC(C)C)O

Isomeric SMILES

CC1=C2C(=CC(=C1)O)CC[C@@](O2)(C)CC/C=C(\C)/CCCC(C)C(=O)[C@H](CC(C)C)O

InChI

InChI=1S/C27H42O4/c1-18(2)15-24(29)25(30)20(4)11-7-9-19(3)10-8-13-27(6)14-12-22-17-23(28)16-21(5)26(22)31-27/h10,16-18,20,24,28-29H,7-9,11-15H2,1-6H3/b19-10+/t20?,24-,27+/m0/s1