ID: 43408
SMILES:C1(=O)C2(CC(C)C1)Oc1c(c(O)cc(CCCCC)c1)C1C2C(C(C)C)CCC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -15.358
InChIKey:YGMAODNIPFUJFT-UHFFFAOYSA-N
ID: 43409
SMILES:C(CCC1=CC2C(CC1)C(C)(C)Oc1c2c(=O)c(C)cc(O)c1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -14.747
InChIKey:WTSJRTOIFIZAQG-UHFFFAOYSA-N
ID: 43410
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(O)(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.762
InChIKey:ICMJYQRNULRNTK-UHFFFAOYSA-N
ID: 43411
SMILES:C(=O)(O)C1=CC2c3c(cc(CCc4ccccc4)cc3O)OC(C)(C)C2CC1
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 378.468
CB1 binding score: -16.356
InChIKey:GBDUXLHWMSEPCO-UHFFFAOYSA-N
ID: 43412
SMILES:CC12C(O)(Cc3c(O)c(C(=O)O)c(CCC)cc3O1)C(C)CCC2C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -12.271
InChIKey:SFUMQZNYALQHGM-UHFFFAOYSA-N
ID: 43413
SMILES:C1(CCC=C(C)C)(C)Oc2cc(CCCCC)cc(OC3OC(CO)C(O)C(O)C3O)c2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.626
CB1 binding score: -15.982
InChIKey:QLIWVHHKSZOIAT-UHFFFAOYSA-N
ID: 43414
SMILES:C1(=O)C2c3c(c(O)cc(CCCCC)c3)OC3(C)C1C(C=C(C)C)CC(C)C23
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -15.487
InChIKey:MBDMVCHEVVRQQR-UHFFFAOYSA-N
ID: 43415
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: 43416
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCCCC)cc2)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 43417
SMILES:C(CCCCCCC(=O)Oc1cc2c(cc1C)OC(C)(C)C1CCC(C)=CC21)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -15.54
InChIKey:GRBXNDRCHZZNAB-UHFFFAOYSA-N
ID: 43418
SMILES:C12C(c3c(cc(C)c(O)c3)OC1(C)C)CC(C)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 244.334
CB1 binding score: -17.127
InChIKey:BWGMMZHGHPMKBT-UHFFFAOYSA-N
ID: 43419
SMILES:c12c(cccc1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.418
InChIKey:UEUDZYHJJLDGIZ-UHFFFAOYSA-N
ID: 43420
SMILES:C(CCCC)Cc1cc2c(c(O)c1C=O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.195
InChIKey:ZUCNOXJMBLPRBT-UHFFFAOYSA-N
ID: 43421
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(C)(O)c3cCc(c12)C(=O)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.526
CB1 binding score: -14.803
InChIKey:RPHGJKZPZGJSLB-UHFFFAOYSA-N
ID: 43422
SMILES:C(CC)CCCc1cc(O)c2c(c1)OC(C)(C)C1=CCC(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.836
InChIKey:UCXILQOLALTYOF-UHFFFAOYSA-N
ID: 43423
SMILES:c1(-c2cc(O)c(C3C(C(C)C)CCC(C)=C3)c(O)c2)c(C=O)c(O)c(OC)c(CC=C(C)CCC=C(C)C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 548.72
CB1 binding score: -16.327
InChIKey:OILZQAODQSNRIW-UHFFFAOYSA-N
ID: 43424
SMILES:C(CCc1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1)Cc1ccc(O)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -15.929
InChIKey:SGLFTHHZVIEXAC-UHFFFAOYSA-N
ID: 43425
SMILES:O=C(O)c1cc2c(c(O)c1CC=C(C)CCC=C(C)C)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -16.309
InChIKey:ZRKQEEUAOFBKAE-UHFFFAOYSA-N
ID: 43426
SMILES:O=Cc1c(O)c2c(cc1CCCCC)OC(C)(C)C1C(=CC2)C(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.222
InChIKey:WUSLZLTXJDREEB-UHFFFAOYSA-N
ID: 43427
SMILES:c1c(C)cc(O)c2c1-c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.696
InChIKey:WNKDAZLOXAUXJL-UHFFFAOYSA-N
ID: 43428
SMILES:C1C(Cl)C(C)(C)Oc2c(O)c3c(c(C(CC(C)C)=O)c2O)oc2c(c3=C1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 529.073
CB1 binding score: -13.095
InChIKey:PYWRMGOPTCMHQC-UHFFFAOYSA-N