ID: 96874
SMILES:C(Cc1c(O)cc(CCCCC)c(C(=O)O)c1O)=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 96875
SMILES:C1CC2C(C)(C)Oc3c(c(O)cc(C(C)C(=O)C)c3)C12C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -12.506
InChIKey:UUMNPHPTHRIRGV-UHFFFAOYSA-N
ID: 96876
SMILES:CC1(C)Oc2c3c(c(O)c(O)c2CCCCC)OC(C)(C)C2C(C(=C)CC1)C23
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.929
InChIKey:GFCZQZOMOVBHSQ-UHFFFAOYSA-N
ID: 96877
SMILES:C(CCC)c1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.792
InChIKey:UGRLMQVLYLFVDE-UHFFFAOYSA-N
ID: 96878
SMILES:CC1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 96879
SMILES:CC1(C)C2C(c3c(O)cc(CCCCC)cc3O1)C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 96880
SMILES:Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.619
InChIKey:MMZAEMNNHWYQKW-UHFFFAOYSA-N
ID: 96881
SMILES:c1(O)cc(O)c(C(=O)CC2(O)C3C(CC2)C(C)(C)Oc2cc(CCCCC)cc(O)c23)c(OC)c1C=CC(C)(C)OCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 596.761
CB1 binding score: -15.607
InChIKey:UZQSBIIHDLJROK-UHFFFAOYSA-N
ID: 96882
SMILES:C1C(C)(O)CCc2c(O)cc(CCCC)cc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -12.839
InChIKey:JIMVZJBOFAZZKI-UHFFFAOYSA-N
ID: 96883
SMILES:CC12C(C(C(C)C)CC1)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.251
InChIKey:GIVNWDNDDALTHM-UHFFFAOYSA-N
ID: 96884
SMILES:CC1CCC2(O)C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.071
InChIKey:UGLNUKBERGJBMI-UHFFFAOYSA-N
ID: 96885
SMILES:C(CNC(c1cc2c(c(O)c1)C1C(C1)C(C)(C)O2)=O)CN1C(=O)C(C)=CC1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.448
CB1 binding score: -15.447
InChIKey:WKOIDGLLPOBDRB-UHFFFAOYSA-N
ID: 96886
SMILES:C(C)(C)=CC(Cc1c(C(=O)O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -15.929
InChIKey:ZGBUXUAZLVNLCW-UHFFFAOYSA-N
ID: 96887
SMILES:C1(C=O)=CCCC2C1c1c(O)cc(C)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -14.694
InChIKey:KEGQVUBGRLLSTJ-UHFFFAOYSA-N
ID: 96888
SMILES:c1(CC=C(C)CCC=C(C)C)c(O)cc(CCCCC)c2c1OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.707
CB1 binding score: -15.568
InChIKey:XYZAURANYRINLY-UHFFFAOYSA-N
ID: 96889
SMILES:CC(c1cc(O)c2c(c1)OC1(C)C(CCC(C)=C1)C2)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.084
InChIKey:BPXQMIIXAUGQGE-UHFFFAOYSA-N
ID: 96890
SMILES:C(C)(C)C1=CC(=O)C(=C)CC1c1c(O)cc(CCCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -15.29
InChIKey:ZLJVKKRWXCBFFS-UHFFFAOYSA-N
ID: 96891
SMILES:c1(CCCCCC)cc(O)c2c(c1)OC(C)(C)C1C2CC(C=O)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.502
InChIKey:NJUSQGSRPAVXII-UHFFFAOYSA-N
ID: 96892
SMILES:C(C(c1c2c(cc(C)c1)OC(C(C)(C)O)CC2)CCCCC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -15.257
InChIKey:XRSJKJFJZUAFTI-UHFFFAOYSA-N
ID: 96893
SMILES:C1CC(C)=CC(c2c(O)cc(CCC)cc2OCCCC)C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.74
InChIKey:AOKDGVZFJONWJT-UHFFFAOYSA-N
ID: 96894
SMILES:C1(c2cc(O)c(C3C=C(C)CCC3C(C)=C)c(O)c2)OC(=O)C(CCC)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -14.113
InChIKey:CZEORRCZQJLRPX-UHFFFAOYSA-N