ID: 65626
SMILES:c1(OC)cc2c(cc1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.071
InChIKey:QJRPBWFSXAYWJJ-UHFFFAOYSA-N
ID: 65627
SMILES:O=C(C(c1c(CCCCC)cc2c(c1O)C1C(O)(C=CC(C)(C)O1)C(C)(C)O2)C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -17.181
InChIKey:JOYVGBVJJXBRSD-UHFFFAOYSA-N
ID: 65628
SMILES:C(=O)(OC1C(CO)=CCCC(CO)=CC2c3c(cc(CCCCC)cc3O2)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -13.638
InChIKey:CIQITKBBRIACPZ-UHFFFAOYSA-N
ID: 65629
SMILES:C1(C(CCC=C(C)C)C)C(c2c(O)cc(CC)cc2O)CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.019
InChIKey:NYEIRUKTKYPWGA-UHFFFAOYSA-N
ID: 65630
SMILES:C(CCc1c(C)cc(O)c2c1OC(C)(C)C1C2CC(C)=CC1=O)OC(CC(=O)CC1C(C)(C)O1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.589
CB1 binding score: -14.844
InChIKey:YVDVHFPDPMTUDR-UHFFFAOYSA-N
ID: 65631
SMILES:CC1(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C(=O)C2=C1CC(C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -15.309
InChIKey:GFJOSXKFPYZAFG-UHFFFAOYSA-N
ID: 65632
SMILES:CC(C(=O)O)C1C(c2c(O)cc(CCCC)cc2O)CC(C)=CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -15.602
InChIKey:NEKCTWIDUPVPGJ-UHFFFAOYSA-N
ID: 65633
SMILES:C1C2C(=C)C(=O)OC2CC2(C)Oc3c(c(OC)cc(CCCCCC)c3)C(O)C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -16.203
InChIKey:BBRDHQXNOXRRPX-UHFFFAOYSA-N
ID: 65634
SMILES:c1cc(CCCCC)c(O)c2c1OC(CO)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -12.913
InChIKey:SUGDSEDXHLWEKL-UHFFFAOYSA-N
ID: 65635
SMILES:C1=CC(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 65636
SMILES:C(CC(C)C)Cc1c2c(c(O)c(C)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.039
InChIKey:VJLPFZQFIPCDMN-UHFFFAOYSA-N
ID: 65637
SMILES:Cc1cc(OCCCCCCC)cc2c1OC(C)(C)C1=C(O2)C(=O)C2(C)C1CCC(C)=CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -15.068
InChIKey:QHRHTWZIUCVRFB-UHFFFAOYSA-N
ID: 65638
SMILES:C(=O)(OCC1(C)C(C=O)=CCC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1)C=C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.618
CB1 binding score: -13.447
InChIKey:MXQVIKPORBGNDD-UHFFFAOYSA-N
ID: 65639
SMILES:C1C2C(C)(Cc3c(OC(C)=O)cc(CCCCC)cc32)CCC1C(C)(OC(C)=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -14.832
InChIKey:KUSUOXIPEFNFOG-UHFFFAOYSA-N
ID: 65640
SMILES:c1cc2c3c(cc(CCCCC)c2)OC(C)(C)OC3C=C(C)CCC=C(CCC=C(C)C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.674
CB1 binding score: -15.708
InChIKey:CKIMOXYAGQVJNP-UHFFFAOYSA-N
ID: 65641
SMILES:C1C=C(C(C)C)C(c2c(OC(=O)C)cc(CCCC)cc2O)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: Not available
InChIKey:VVDSPKDTLYOTMS-UHFFFAOYSA-N
ID: 65642
SMILES:C(CCCc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.609
InChIKey:HAKUWGCTBUVNJQ-UHFFFAOYSA-N
ID: 65643
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)(C)O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 65644
SMILES:c1(O)c(C(O)=O)c(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)(O)C1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.529
CB1 binding score: -15.67
InChIKey:POHKIGZFDTWVFH-UHFFFAOYSA-N
ID: 65645
SMILES:c12c(O)c(CC=C(C)CCC=C(C)C)c(O)c(C(C(CC)C)=O)c1OC(C)(C)C1CCC(C)(O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.704
CB1 binding score: -16.041
InChIKey:APFOEIVXGMKWEJ-UHFFFAOYSA-N
ID: 65646
SMILES:C(CCCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N