ID: 121444
SMILES:O(c1cc(C(CC(C)C)=O)c(OC)c(O)c1C1C(C(C)=C)CCC(C)=C1)CC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -14.878
InChIKey:XJACNYAYGJMKPD-UHFFFAOYSA-N
ID: 121445
SMILES:O(C)c1c(CC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -19.169
InChIKey:FCNLMUQPSJEBQE-UHFFFAOYSA-N
ID: 121446
SMILES:c12cc(CCCCC)cc(O)c1OC1C(C(C)C)CCC(C)(O2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.929
InChIKey:OOWVXKGDWTZCGR-UHFFFAOYSA-N
ID: 121447
SMILES:C1(C(C(OC(C)=O)CC2=CC(=O)OC2)(C)C)CCc2cc(O)ccc2OC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -13.941
InChIKey:VZSYLUHZQYBFJS-UHFFFAOYSA-N
ID: 121448
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 121449
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2CO)CC2C(COC(CCC)=O)CCC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.628
CB1 binding score: -14.559
InChIKey:SIJWKPMCDVAUMM-UHFFFAOYSA-N
ID: 121450
SMILES:C(CCC=C(C)C)(C)=CCc1c(O)c(C(O)=O)c(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -19.667
InChIKey:FAVCTJGKHFHFHJ-UHFFFAOYSA-N
ID: 121451
SMILES:c1(C)cc2c(cc1)C(COc1cc(CCCCC)cc(O)c1)C(C(C)=C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.556
CB1 binding score: -16.037
InChIKey:QVZYRFUOPJQDDA-UHFFFAOYSA-N
ID: 121452
SMILES:C1C2C(CC(C)=C1)c1c(cc(=O)c(OC)cc1)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.568
InChIKey:BSJIGXMGRSMMPY-UHFFFAOYSA-N
ID: 121453
SMILES:C1C(C)=CC(c2c(O)cc(CCCCC)cc2OC)C(C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -21.398
InChIKey:WPVARKYNWHKQMW-UHFFFAOYSA-N
ID: 121454
SMILES:OC(CC=C(C)C)C(=CCCC(C)=CCc1c(O)cc(CCCCCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.684
CB1 binding score: -18.409
InChIKey:MQCWDKANIIWDBC-UHFFFAOYSA-N
ID: 121455
SMILES:c1(CC=C(C)C)c(C2C(C(=C)C)CCC(C)=C2)c(O)c(C=O)c(O)c1CC=C(C)C=CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 542.804
CB1 binding score: -15.525
InChIKey:DTGWLYJJFCMJSI-UHFFFAOYSA-N
ID: 121456
SMILES:CC12CCC3C(C)(C)Oc4c(cc(CCCCC)cc4O)C(C(C)=C)CC13O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -14.218
InChIKey:OMCAKOSFSAVBEY-UHFFFAOYSA-N
ID: 121457
SMILES:C1(C)C2(Oc3c1c(O)cc(CCCCC)c3)C(C)C(CCC=C(C)C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -11.93
InChIKey:ZFAQJVXASDCMMD-UHFFFAOYSA-N
ID: 121458
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 121459
SMILES:C1C=C(C)CCC2C(C)(C)Oc3cc(C)ccc3C12
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 256.389
CB1 binding score: -17.194
InChIKey:WIOSFWDNUILLER-UHFFFAOYSA-N
ID: 121460
SMILES:C1C2(C)C3Cc4c(O)cc(CCCCC)cc4OC3(C)CCC2C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.432
InChIKey:ZAHVFSWPQJJZAC-UHFFFAOYSA-N
ID: 121461
SMILES:C(CCC(=CCc1cc(OC)cc(C)c1O)C)=C(CC1C=C(C)CCC1C(=C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -15.397
InChIKey:TUFXBOVABCYDDQ-UHFFFAOYSA-N
ID: 121462
SMILES:c1(O)c(C)c(O)c2c(c1)OC(C)(C)C1CC(=O)C(C)C(O)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.358
CB1 binding score: -16.327
InChIKey:HSKPJPQBTRHSGI-UHFFFAOYSA-N
ID: 121463
SMILES:c12cc(O)ccc1OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.07
InChIKey:LIEZPCZOEMYUIR-UHFFFAOYSA-N
ID: 121464
SMILES:Oc1c(C2C(C(C)=CC)C(C(=O)O)CCC(C)C2)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -14.693
InChIKey:JOVKGTQQDUSUJA-UHFFFAOYSA-N