ID: 132532
SMILES:C(C(=O)OC)C1C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.406
InChIKey:NDGIKGVCIMVUHD-UHFFFAOYSA-N
ID: 132533
SMILES:C(c1c(O)c2c(cc1Br)OC(C)(C)C1CCC(C)=CC21)CCCCCCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 491.554
CB1 binding score: -14.413
InChIKey:YZRHBMMJAPBICE-UHFFFAOYSA-N
ID: 132534
SMILES:Oc1c(CC=C(C)C)c(OC)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -19.169
InChIKey:FCNLMUQPSJEBQE-UHFFFAOYSA-N
ID: 132535
SMILES:CC(=CCc1c(O)cc(CCCCC)cc1OC)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -19.169
InChIKey:FCNLMUQPSJEBQE-UHFFFAOYSA-N
ID: 132536
SMILES:Oc1cc2c(cc1C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.623
InChIKey:MUNXTPXTGBOZLU-UHFFFAOYSA-N
ID: 132537
SMILES:c1c(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 300.486
CB1 binding score: -19.003
InChIKey:KXYIDYXHLDYCQN-UHFFFAOYSA-N
ID: 132538
SMILES:O=C(c1c(CCCCC)cc(O)c2c1OC1C(O)(C)CCC(C(=C)C)C12)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.252
InChIKey:HJMCQDCJBFTRPX-UHFFFAOYSA-N
ID: 132539
SMILES:C(CCC=C(C)C)(=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 132540
SMILES:C(Cc1c2c(c(C)cc1OC)CC1C(C)(O2)CCC1C(C)=C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.864
InChIKey:BVCCJDTZAGURSG-UHFFFAOYSA-N
ID: 132541
SMILES:C1(C)=CC(c2c(O)cc(CCC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 132542
SMILES:Oc1cc(CCCCC)cc2c1C1CC(CC=C(C)C)(C(C)=CCC1C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -17.489
InChIKey:WQQCULMOOLFBAR-UHFFFAOYSA-N
ID: 132543
SMILES:C1(O)(C)CC2C(CC1)C(C)(C)Oc1c2c(O)cc(CO)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -16.791
InChIKey:UNJKBASTZWRNTE-UHFFFAOYSA-N
ID: 132544
SMILES:CC(=CC(c1c(O)c(C=O)c(O)c2c1OC(C)(C)C1CCC(C)=CC21)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -11.984
InChIKey:ZRRSXKZSIYWEOH-UHFFFAOYSA-N
ID: 132545
SMILES:C1c2c(ccc(CCCCC)c2)OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.34
CB1 binding score: -17.996
InChIKey:VJURYNGAHUGCKH-UHFFFAOYSA-N
ID: 132546
SMILES:C(C)(C1C(OC(C=CC)=O)CC(C)=CC1c1c(O)cc(CCC)cc1O)(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.239
InChIKey:ZJGOIBARVPSJTE-UHFFFAOYSA-N
ID: 132547
SMILES:c1c(C2C=C(C)CCC2C(=C)C)c(O)cc(OC)c1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.056
InChIKey:VOIMBTHXPILBSP-UHFFFAOYSA-N
ID: 132548
SMILES:C12(C)CC(=O)C=C(C)C1(O)CCC1(C)Oc3c(cc(O)c(CCCCC)c3)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -15.094
InChIKey:QIZIGIPZJNMDTF-UHFFFAOYSA-N
ID: 132549
SMILES:Oc1c(CC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 132550
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2C(O)C(C)CC1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.565
CB1 binding score: -16.414
InChIKey:HBSFDJLUZYQSHF-UHFFFAOYSA-N
ID: 132551
SMILES:C1(CC(=O)O)(C)C(C(=C)C)CCC(C)=C1CCC(C)=CCc1c(O)ccc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -15.933
InChIKey:QQJDUDVXJBJYOQ-UHFFFAOYSA-N
ID: 132552
SMILES:C1(C(C(=O)O)=C)CCC(C)=CC1c1c(O)cc(CC=C(C)C)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.891
InChIKey:AIASOAYMOUWZBU-UHFFFAOYSA-N